SCHEMBL16665668

SCHEMBL16665668

Cc1noc(C)c1-c1nc(NC2CCN(C(=O)c3ccc(NC(=O)OC(C)(C)C)cc3)CC2)ncc1Cl

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CDK12 Q9NYV4 18/20 0.53
CCNK O75909 17/20 0.53
CDK13 Q14004 2/20 0.49
CCNT1 O60563 1/20 0.45
CCNA2 P20248 1/20 0.45
CDK2 P24941 1/20 0.45
CDK7 P50613 1/20 0.45
CDK9 P50750 1/20 0.45
CCNH P51946 1/20 0.45
MAPK8 P45983 1/20 0.45
MAPK9 P45984 1/20 0.45
NAMPT P43490 1/20 0.43

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
SCHEMBL16665700 0.87 CDK12 (0.54) CDK12CCNKCDK13CCNT1CCNA2
SCHEMBL18074048 0.85 CCNK (0.51) CDK12CCNKCDK13CCNA2CDK2
SCHEMBL16665591 0.85 CDK12 (0.51) CDK12CCNKCDK13CCNT1CCNA2
SCHEMBL16665770 0.84 CCNK (0.65) CDK12CCNKCDK13CCNT1CCNA2
SCHEMBL18047402 0.84 CCNK (0.65) CDK12CCNKCDK13CCNT1CCNA2
SCHEMBL16665701 0.84 CCNK (0.57) CDK12CCNKCDK13CCNT1CCNA2
SCHEMBL16665735 0.83 CDK12 (0.48) CDK12CCNKCDK13CCNT1CCNA2
SCHEMBL16665676 0.82 CDK12 (0.48) CDK12CCNKCDK13CCNT1CCNA2
SCHEMBL16665658 0.78 CDK12 (0.44) CDK12CCNKCDK13CCNT1CCNA2
SCHEMBL16665652 0.78 BTK (0.41) CDK7CDK9MAPK8MAPK9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-20160264552-A1 HETEROMAROMATIC COMPOUNDS USEFUL FOR THE TREATMENT OF PROLFERATIVE DISEASES SYROS PHARMACEUTICALS INC (US) 2016-09-15 US 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 (2 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 CDK12 27/4885CCNK 10/4885CDK13 22/4885
US-20160264552-A1 HETEROMAROMATIC COMPOUNDS USEFUL FOR THE TREATMENT OF PROLFERATIVE DISEASES CDK7, CDK6, CDK3 CDK12 27/4885CCNK 9/4885CDK13 31/4885

“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.