SCHEMBL17009252

SCHEMBL17009252

O=C(NCc1cccs1)c1cccs1

nearest known ligand 0.71

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.71
SMN1; SMN2 Q16637 3/20 0.71
NPC1 O15118 2/20 0.71
HPGD P15428 12/20 0.68
TSHR P16473 4/20 0.68
ALDH1A1 P00352 4/20 0.65
HTT P42858 3/20 0.65
HSD17B10 Q99714 1/20 0.65
POLB P06746 2/20 0.64
KDM4E B2RXH2 1/20 0.64
USP2 O75604 2/20 0.60
TP53 P04637 1/20 0.58
HDAC1 Q13547 1/20 0.58

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
SCHEMBL14096508 0.84 ALDH1A1 (0.61) RAB9ASMN1; SMN2NPC1HPGDTSHR
SCHEMBL14142610 0.81 LMNA (0.80) RAB9ASMN1; SMN2NPC1HPGDTSHR
SCHEMBL18415485 0.81 POLB (0.72) RAB9ASMN1; SMN2NPC1HPGDTSHR
SCHEMBL2234130 0.81 HPGD (1.00) RAB9ASMN1; SMN2NPC1HPGDALDH1A1
SCHEMBL2925459 0.81 NPC1 (0.71) RAB9ASMN1; SMN2NPC1HPGDTSHR
SCHEMBL7503385 0.79 KDM4E (0.70) RAB9ASMN1; SMN2NPC1HPGDTSHR
SCHEMBL3561734 0.79 POLB (0.70) HPGDTSHRALDH1A1HTTHSD17B10
Hydrochloric Acid SCHEMBL28152221 0.79 HPGD (0.97) RAB9ASMN1; SMN2NPC1HPGDALDH1A1
SCHEMBL9401179 0.78 ALDH1A1 (0.59) RAB9ASMN1; SMN2NPC1HPGDTSHR
SCHEMBL1454563 0.78 POLB (0.73) RAB9ASMN1; SMN2NPC1HPGDTSHR

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-20210145796-A1 METHODS FOR ADMINISTERING COMPOSITIONS INCLUDING INTEGRIN AGONISTS HAVING ANTI-TUMOR ACTIVITY 7 HILLS PHARMA INC. 2021-05-20 US disclosed
US-20210023207-A1 NOVEL INTEGRIN ACTIVATOR VACCINE COMPOSITIONS 7 Hills Pharma LLC (US) 2021-01-28 US disclosed
US-10716849-B2 Methods of administering novel integrin activator vaccine compositions 7 Hills Pharma LLC (US) 2020-07-21 US disclosed
US-10709781-B2 Integrin activator checkpoint inhibitor compositions 7 Hills Pharma LLC (US) 2020-07-14 US disclosed
US-10709780-B2 Integrin activator vaccine compositions 7 Hills Pharma LLC (US) 2020-07-14 US disclosed
US-20200054743-A1 NOVEL INTEGRIN ACTIVATOR CHECKPOINT INHIBITOR COMPOSITIONS 7 Hills Pharma LLC (US) 2020-02-20 US disclosed
US-20200054600-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS FOR SYSTEMIC TREATMENT OF SOLID TUMORS 7 HILLS INTERESTS LLC (US) 2020-02-20 US disclosed
US-20190351052-A1 NOVEL INTEGRIN ACTIVATOR VACCINE COMPOSITIONS 7 Hills Pharma LLC (US) 2019-11-21 US disclosed
US-20190343952-A1 METHODS OF ADMINISTERING NOVEL INTEGRIN ACTIVATOR VACCINE COMPOSITIONS 7 Hills Pharma LLC (US) 2019-11-14 US disclosed
US-10342866-B2 Compositions and methods for immunotherapies comprising small molecule integrin receptor-ligand agonist adjuvants 7 HILLS INTERESTS LLC (US) 2019-07-09 US disclosed
CN-107820429-A Include the new compositions and method for immunization therapy of small molecule integrin receptors ligand activator adjuvant 7山利益有限责任公司 2018-03-20 CN disclosed
EP-3288585-A2 NOVEL COMPOSITIONS AND METHODS FOR IMMUNOTHERAPIES COMPRISING SMALL MOLECULE INTEGRIN RECEPTOR-LIGAND AGONIST ADJUVANTS 7 HILLS INTERESTS, LLC (US) 2018-03-07 EP disclosed
CN-106604727-A Compositions and methods to improve adoptive cell therapies 7山利益有限责任公司 2017-04-26 CN disclosed
EP-3104867-A1 COMPOSITIONS AND METHODS TO IMPROVE THE HOMING AND GRAFTING OF HEMATOPOETIC STEM CELLS 7 HILLS INTERESTS, LLC (US) 2016-12-21 EP disclosed
US-20160339098-A1 Novel compositions and methods for immunotherapies comprising small molecule integrin receptor-ligand agonist adjuvants 7 HILLS PHARMA INC. 2016-11-24 US disclosed
WO-2016176400-A2 NOVEL COMPOSITIONS AND METHODS FOR IMMUNOTHERAPIES COMPRISING SMALL MOLECULE INTEGRIN RECEPTOR-LIGAND AGONIST ADJUVANTS 7 HILLS INTERESTS LLC (US) 2016-11-03 WO 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

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

For each of this compound's patents that has machine-readable text (11 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-20200054743-A1 NOVEL INTEGRIN ACTIVATOR CHECKPOINT INHIBITOR COMPOSITIONS CD47, ITGA1, ITGA2B RAB9A 1472/4885SMN1; SMN2 2630/4885NPC1 4131/4885
US-10709781-B2 Integrin activator checkpoint inhibitor compositions CD47, ITGA1, ITGAM RAB9A 1568/4885SMN1; SMN2 2655/4885NPC1 4132/4885
US-10716849-B2 Methods of administering novel integrin activator vaccine compositions ITGAM, ITGA2B, ITGA2 RAB9A 1454/4885SMN1; SMN2 2081/4885NPC1 3036/4885
US-20190351052-A1 NOVEL INTEGRIN ACTIVATOR VACCINE COMPOSITIONS ITGAM, ITGA2B, ITGA1 RAB9A 729/4885SMN1; SMN2 2768/4885NPC1 3027/4885
US-20190343952-A1 METHODS OF ADMINISTERING NOVEL INTEGRIN ACTIVATOR VACCINE COMPOSITIONS ITGAM, ITGA2B, ITGA2 RAB9A 1454/4885SMN1; SMN2 2081/4885NPC1 3036/4885
US-20200054600-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS FOR SYSTEMIC TREATMENT OF SOLID TUMORS VCAM1, ITGB1, ITGA1 RAB9A 3744/4885SMN1; SMN2 1141/4885NPC1 1799/4885
US-20210145796-A1 METHODS FOR ADMINISTERING COMPOSITIONS INCLUDING INTEGRIN AGONISTS HAVING ANTI-TUMOR ACTIVITY ITGB7, ITGA1, ITGAL RAB9A 1429/4885SMN1; SMN2 727/4885NPC1 2875/4885
US-10709780-B2 Integrin activator vaccine compositions ITGAM, ITGA2B, ITGA1 RAB9A 847/4885SMN1; SMN2 2765/4885NPC1 3269/4885
US-20210023207-A1 NOVEL INTEGRIN ACTIVATOR VACCINE COMPOSITIONS ITGA2B, ITGAM, ITGAV RAB9A 542/4885SMN1; SMN2 2335/4885NPC1 2793/4885
US-10342866-B2 Compositions and methods for immunotherapies comprising small molecule integrin receptor-ligand agonist adjuvants CD4, ICOS, CD274 RAB9A 1598/4885SMN1; SMN2 2050/4885NPC1 2144/4885
US-20160339098-A1 Novel compositions and methods for immunotherapies comprising small molecule integrin receptor-ligand agonist adjuvants CD4, CD274, ICOS RAB9A 1646/4885SMN1; SMN2 1988/4885NPC1 2119/4885

“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.