SCHEMBL13525124

SCHEMBL13525124

CC(=O)CCCCC1SC[C@H]2NC(=O)N[C@@H]12

nearest known ligand 0.77

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 6/20 0.77
▸ MEN1 O00255 1/20 0.77
▸ ABL1 P00519 1/20 0.77
▸ LMNA P02545 1/20 0.77
▸ PKM P14618 1/20 0.77
▸ IDE P14735 1/20 0.77
▸ MAPK1 P28482 1/20 0.77
▸ KMT2A Q03164 1/20 0.77
▸ RIN1 Q13671 1/20 0.77
▸ L3MBTL1 Q9Y468 1/20 0.77
▸ HLCS P50747 6/20 0.69
▸ CA12 O43570 7/20 0.55
▸ CA1 P00915 7/20 0.55
▸ CA2 P00918 7/20 0.55
▸ CA9 Q16790 7/20 0.55

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
SCHEMBL17348120 1.00 TDP1 (0.77) TDP1MEN1ABL1LMNAPKM
SCHEMBL12852783 1.00 TDP1 (0.77) TDP1MEN1ABL1LMNAPKM
SCHEMBL18413943 1.00 TDP1 (0.77) TDP1MEN1ABL1LMNAPKM
SCHEMBL12060446 1.00 TDP1 (0.77) TDP1MEN1ABL1LMNAPKM
SCHEMBL13380511 1.00 TDP1 (0.77) TDP1MEN1ABL1LMNAPKM
SCHEMBL13563116 1.00 TDP1 (0.77) TDP1MEN1ABL1LMNAPKM
SCHEMBL14594154 1.00 TDP1 (0.77) TDP1MEN1ABL1LMNAPKM
SCHEMBL6751270 1.00 TDP1 (0.77) TDP1MEN1ABL1LMNAPKM
SCHEMBL12119296 1.00 TDP1 (0.77) TDP1MEN1ABL1LMNAPKM
SCHEMBL13525109 1.00 TDP1 (0.77) TDP1MEN1ABL1LMNAPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3057991-B1 CHIMERIC ANTIGEN RECEPTOR T CELL SWITCHES AND USES THEREOF THE CALIFORNIA INSTITUTE FOR BIOMEDICAL RES (US) 2019-05-08 — — EP disclosed
US-9636374-B2 pH-sensitive polymer-drug conjugates for targeted delivery of therapeutics NORTHWESTERN UNIVERSITY (US) 2017-05-02 — — US disclosed
US-20150359837-A1 pH-Sensitive Polymer-Drug Conjugates for Targeted Delivery of Therapeutics NORTHWESTERN UNIVERSITY 2015-12-17 — — US disclosed
US-20150238631-A1 CHIMERIC ANTIGEN RECEPTOR T CELL SWITCHES AND USES THEREOF THE CALIFORNIA INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2015-08-27 — — US disclosed
US-9034829-B1 pH-sensitive polymer-drug conjugates for targeted delivery of therapeutics NORTHWESTERN UNIVERSITY (US) 2015-05-19 — — US disclosed
WO-2015057852-A1 CHIMERIC ANTIGEN RECEPTOR T CELL SWITCHES AND USES THEREOF THE CALIFORNIA INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2015-04-23 — — WO disclosed
US-8298513-B2 Hexatriene-β-carbonyl compound OSAKA UNIVERSITY (JP) 2012-10-30 — — US disclosed
US-20100008857-A1 NOVEL HEXATRIENE-BETA-CARBONYL COMPOUND OSAKA UNIVERSITY (JP) 2010-01-14 — — US disclosed
EP-2128124-A1 NOVEL HEXATRIENE- -CARBONYL COMPOUND Osaka University (JP) 2009-12-02 — — EP 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 (3 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-20150238631-A1 CHIMERIC ANTIGEN RECEPTOR T CELL SWITCHES AND USES THEREOF ICOS, HAVCR2, CD2 TDP1 1760/4885MEN1 4384/4885ABL1 1699/4885
US-20100008857-A1 NOVEL HEXATRIENE-BETA-CARBONYL COMPOUND CBR1, CBR3, DCXR TDP1 4770/4885MEN1 4487/4885ABL1 4163/4885
US-20150359837-A1 pH-Sensitive Polymer-Drug Conjugates for Targeted Delivery of Therapeutics CA6, CA7, CA12 TDP1 1670/4885MEN1 744/4885ABL1 214/4885

“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.

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