SCHEMBL6122227

SCHEMBL6122227

CCCC[C@H](NC(=O)NC(C)(C)C)C(=O)N(Cc1cccs1)Cc1cccs1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CTSK P43235 3/20 0.47
RIPK1 Q13546 1/20 0.44
ALDH1A1 P00352 3/20 0.41
CYP3A4 P08684 2/20 0.41
CYP2D6 P10635 2/20 0.41
CYP2C19 P33261 2/20 0.41
CYP2C9 P11712 1/20 0.41
GAA P10253 2/20 0.40
TRPM8 Q7Z2W7 5/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
CHRM2 P08172 1/20 0.39
CHRM1 P11229 1/20 0.39
CHRM3 P20309 1/20 0.39
POLB P06746 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
KMT2A Q03164 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6121971 0.88 CTSK (0.44) CTSKALDH1A1GAATRPM8SMN1; SMN2
SCHEMBL15239340 0.87 CTSK (0.44) CTSKRIPK1ALDH1A1GAATRPM8
SCHEMBL6122567 0.87 CTSK (0.45) CTSKALDH1A1GAATRPM8CHRM2
SCHEMBL16762075 0.85 ALDH1A1 (0.46) CTSKALDH1A1GAATRPM8SMN1; SMN2
SCHEMBL6123072 0.85 CTSK (0.46) CTSKALDH1A1GAATRPM8SMN1; SMN2
SCHEMBL6121764 0.85 CTSK (0.46) CTSKALDH1A1GAATRPM8SMN1; SMN2
SCHEMBL16762178 0.85 ALDH1A1 (0.46) CTSKALDH1A1GAATRPM8SMN1; SMN2
SCHEMBL6982875 0.84 ALDH1A1 (0.53) CTSKALDH1A1GAATRPM8SMN1; SMN2
SCHEMBL21715224 0.84 CTSK (0.67) CTSK
SCHEMBL31277282 0.84 CTSK (0.67) CTSK

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 47 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2640721-A2 AGONISTS THAT ENHANCE BINDING OF INTEGRIN-EXPRESSING CELLS TO INTEGRIN RECEPTORS Texas Heart Institute (US) 2013-09-25 EP claimed
US-20130236434-A1 AGONISTS THAT ENHANCE BINDING OF INTEGRIN-EXPRESSING CELLS TO INTEGRIN RECEPTORS TEXAS HEART INSTITUTE (US) 2013-09-12 US claimed
WO-2012068251-A2 AGONISTS THAT ENHANCE BINDING OF INTEGRIN-EXPRESSING CELLS TO INTEGRIN RECEPTORS TEXAS HEART INSTITUTE (US) 2012-05-24 WO claimed
US-12636274-B2 Pharmaceutical compositions and methods for systemic treatment of solid tumors 7 HILLS PHARMA INC. (US) 2026-05-26 US disclosed
US-12201686-B2 Compositions including a therapeutic antibodies and/or a checkpoint inhibitor and an integrin activating compound 7 HILLS PHARMA INC. (US) 2025-01-21 US disclosed
US-20240189360-A1 COMPOSITIONS AND METHODS TO IMPROVE THE HOMING AND GRAFTING OF HEMATOPOETIC STEM CELLS 7 HILLS PHARMA INC. (US) 2024-06-13 US disclosed
US-11484524-B2 Compositions and methods to improve adoptive cell therapies 7 Hills Pharma LLC (US) 2022-11-01 US disclosed
CN-107820429-B Novel compositions and methods for immunotherapy comprising small molecule integrin receptor-ligand agonist adjuvants 7山药物有限责任公司 2022-08-16 CN disclosed
US-11311619-B2 Integrin activator vaccine compositions 7 Hills Pharma Inc. and Texas Heart Institute (US) 2022-04-26 US disclosed
EP-3104867-B1 COMPOSITIONS AND METHODS TO IMPROVE THE HOMING AND GRAFTING OF HEMATOPOETIC STEM CELLS 7 Hills Pharma LLC (US) 2022-01-19 EP disclosed
US-20220001009-A1 NOVEL COMPOSITIONS INCLUDING A THERAPEUTIC ANTIBODIES AND/OR A CHECKPOINT INHIBITOR AND AN INTEGRIN ACTIVATING COMPOUND 7 Hills Pharma LLC (US) 2022-01-06 US disclosed
US-20150368234-A1 AGONISTS THAT ENHANCED BINDING OF INTEGRIN-EXPRESSING CELLS TO INTEGRIN RECEPTORS TEXAS HEART INSTITUTE 2015-12-24 US disclosed
US-20150291571-A1 AGONISTS THAT ENHANCED BINDING OF INTEGRIN-EXPRESSING CELLS TO INTEGRIN RECEPTORS TEXAS HEART INSTITUTE 2015-10-15 US disclosed
US-20150250883-A1 COMPOSITIONS AND METHODS TO IMPROVE THE HOMING AND GRAFTING OF HEMATOPOETIC STEM CELLS 7 HILLS PHARMA INC. 2015-09-10 US disclosed
WO-2015123447-A1 COMPOSITIONS AND METHODS TO IMPROVE THE HOMING AND GRAFTING OF HEMATOPOETIC STEM CELLS 7 HILLS PHARMA, LLC (US) 2015-08-20 WO disclosed
EP-2881392-A1 Agonists that enhance binding of integrin-expressing cells to integrin receptors Texas Heart Institute (US) 2015-06-10 EP disclosed
EP-2881393-A1 Agonists that enhance binding of integrin-expressing cells to integrin receptors Texas Heart Institute (US) 2015-06-10 EP disclosed
EP-2640721-A2 AGONISTS THAT ENHANCE BINDING OF INTEGRIN-EXPRESSING CELLS TO INTEGRIN RECEPTORS Texas Heart Institute (US) 2013-09-25 EP disclosed
US-20130236434-A1 AGONISTS THAT ENHANCE BINDING OF INTEGRIN-EXPRESSING CELLS TO INTEGRIN RECEPTORS TEXAS HEART INSTITUTE (US) 2013-09-12 US disclosed
WO-2012068251-A2 AGONISTS THAT ENHANCE BINDING OF INTEGRIN-EXPRESSING CELLS TO INTEGRIN RECEPTORS TEXAS HEART INSTITUTE (US) 2012-05-24 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (10 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11311619-B2 Integrin activator vaccine compositions ITGAM, ITGA2B, ITGA1 CTSK 1937/4885RIPK1 3135/4885ALDH1A1 3698/4885
US-11484524-B2 Compositions and methods to improve adoptive cell therapies ITGB7, ITGB1, ITGA1 CTSK 2537/4885RIPK1 4116/4885ALDH1A1 669/4885
US-20220001009-A1 NOVEL COMPOSITIONS INCLUDING A THERAPEUTIC ANTIBODIES AND/OR A CHECKPOINT INHIBITOR AND AN INTEGRIN ACTIVATING COMPOUND CD47, ITGB1, ITGAM CTSK 2541/4885RIPK1 781/4885ALDH1A1 2925/4885
US-12636274-B2 Pharmaceutical compositions and methods for systemic treatment of solid tumors CD4, VCAM1, ITGA1 CTSK 1100/4885RIPK1 2389/4885ALDH1A1 1970/4885
US-20130236434-A1 AGONISTS THAT ENHANCE BINDING OF INTEGRIN-EXPRESSING CELLS TO INTEGRIN RECEPTORS ITGB7, ITGAL, ITGB1 CTSK 3114/4885RIPK1 4184/4885ALDH1A1 755/4885
US-20150250883-A1 COMPOSITIONS AND METHODS TO IMPROVE THE HOMING AND GRAFTING OF HEMATOPOETIC STEM CELLS ITGB7, ITGB1, ITGA1 CTSK 3822/4885RIPK1 4261/4885ALDH1A1 342/4885
US-12201686-B2 Compositions including a therapeutic antibodies and/or a checkpoint inhibitor and an integrin activating compound CD47, CD274, ITGB1 CTSK 2225/4885RIPK1 949/4885ALDH1A1 2356/4885
US-20150291571-A1 AGONISTS THAT ENHANCED BINDING OF INTEGRIN-EXPRESSING CELLS TO INTEGRIN RECEPTORS ITGB7, ITGAL, ITGB1 CTSK 3030/4885RIPK1 4086/4885ALDH1A1 740/4885
US-20150368234-A1 AGONISTS THAT ENHANCED BINDING OF INTEGRIN-EXPRESSING CELLS TO INTEGRIN RECEPTORS ITGB7, ITGAL, ITGB1 CTSK 3030/4885RIPK1 4086/4885ALDH1A1 740/4885
US-20240189360-A1 COMPOSITIONS AND METHODS TO IMPROVE THE HOMING AND GRAFTING OF HEMATOPOETIC STEM CELLS CXCL12, ITGB3, ITGB7 CTSK 3406/4885RIPK1 4130/4885ALDH1A1 1083/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.