SCHEMBL16655014

SCHEMBL16655014

O=S(=O)(c1ccccc1)n1c(-c2nc(Cl)ncc2Cl)cc2ccccc21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.51
CA9 Q16790 3/20 0.51
CA2 P00918 1/20 0.51
RECQL P46063 1/20 0.47
ACLY P53396 2/20 0.45
ALDH1A1 P00352 2/20 0.45
LMNA P02545 2/20 0.45
MAPT P10636 1/20 0.45
CCR2 P41597 1/20 0.44
ABL1 P00519 1/20 0.39
BCR P11274 1/20 0.39
NOD1 Q9Y239 3/20 0.39
CXCL8 P10145 1/20 0.39
PPARG P37231 2/20 0.39
PPARD Q03181 2/20 0.39
PPARA Q07869 2/20 0.39
CREBBP Q92793 1/20 0.38
ATR Q13535 1/20 0.38
ATRIP Q8WXE1 1/20 0.38
BCL2 P10415 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
SCHEMBL30886775 1.00 CA12 (0.51) CA12CA9CA2RECQLACLY
SCHEMBL30886774 0.88 CA12 (0.49) CA12CA9CA2RECQLACLY
SCHEMBL30886779 0.82 CA12 (0.43) CA12CA9CA2RECQLACLY
SCHEMBL30556278 0.79 NOD2 (0.38) RECQLACLYCCR2NOD1NOD2
SCHEMBL16654851 0.75 HTR6 (0.53) ACLYLMNANOD1CXCL8DCTPP1
SCHEMBL29174697 0.75 PKM (0.44) ALDH1A1ABL1BCRHTR6
SCHEMBL30556293 0.75 KMT2A (0.49) RECQLALDH1A1MAPTMCL1MEN1
SCHEMBL3558164 0.74 CA12 (0.78) CA12CA9CA2RECQLACLY
SCHEMBL28204828 0.72 CA12 (0.55) CA12CA9CA2RECQLACLY
SCHEMBL6039811 0.72 HTR6 (0.56) CA12CA9CA2HTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210061803-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) SYROS PHARMACEUTICALS INC (US) 2021-03-04 US disclosed
US-20190292167-A1 HETEROAROMATIC COMPOUNDS USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES SYROS PHARMACEUTICALS INC (US) 2019-09-26 US disclosed
US-20160264552-A1 HETEROMAROMATIC COMPOUNDS USEFUL FOR THE TREATMENT OF PROLFERATIVE DISEASES SYROS PHARMACEUTICALS INC (US) 2016-09-15 US disclosed
EP-3057954-A2 HETEROMAROMATIC COMPOUNDS USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES Syros Pharmaceuticals, Inc. (US) 2016-08-24 EP disclosed
WO-2015058163-A2 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) SYROS PHARMACEUTICALS, INC. (US) 2015-04-23 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 (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-20190292167-A1 HETEROAROMATIC COMPOUNDS USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES CDK7, CDK3, CDK17 CA12 3363/4885CA9 1389/4885CA2 1457/4885
US-20160264552-A1 HETEROMAROMATIC COMPOUNDS USEFUL FOR THE TREATMENT OF PROLFERATIVE DISEASES CDK7, CDK6, CDK3 CA12 3289/4885CA9 1777/4885CA2 1239/4885
US-20210061803-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) CDK7, CDK3, CDK9 CA12 3537/4885CA9 1201/4885CA2 1515/4885

“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.