SCHEMBL30464385

SCHEMBL30464385

C=CC(=O)Nc1ccc2c(c1)nc(N1CC[C@H](F)[C@@H](Nc3ncc(C(F)(F)F)cn3)C1)n2C

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CCNK O75909 10/20 0.44
CDK12 Q9NYV4 10/20 0.44
CCNA2 P20248 9/20 0.43
CDK2 P24941 9/20 0.43
CDK7 P50613 9/20 0.43
CCNH P51946 9/20 0.43
MNAT1 P51948 9/20 0.43
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
EGFR P00533 4/20 0.40
MCHR1 Q99705 1/20 0.39
F13A1 P00488 1/20 0.39
TGM2 P21980 1/20 0.39
TGM1 P22735 1/20 0.39

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
SCHEMBL25221183 1.00 CCNK (0.44) CCNKCDK12CCNA2CDK2CDK7
SCHEMBL25268712 1.00 CCNK (0.44) CCNKCDK12CCNA2CDK2CDK7
SCHEMBL30464490 1.00 CCNK (0.44) CCNKCDK12CCNA2CDK2CDK7
SCHEMBL30533844 0.88 CCNK (0.49) CCNKCDK12CCNA2CDK2CDK7
SCHEMBL25224265 0.88 CCNK (0.49) CCNKCDK12CCNA2CDK2CDK7
SCHEMBL25216702 0.88 CCNK (0.49) CCNKCDK12CCNA2CDK2CDK7
SCHEMBL25233481 0.88 CCNK (0.49) CCNKCDK12CCNA2CDK2CDK7
SCHEMBL30533851 0.88 CCNK (0.49) CCNKCDK12CCNA2CDK2CDK7
SCHEMBL25216698 0.87 CCNK (0.42) CCNKCDK12CCNA2CDK2CDK7
SCHEMBL25222746 0.87 CCNK (0.42) CCNKCDK12CCNA2CDK2CDK7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023102184-A1 BICYCLIC AMINE COMPOUNDS AS CDK12 INHIBITORS INCYTE CORPORATION (US) 2023-06-08 WO claimed
US-20230203010-A1 BICYCLIC AMINE CDK12 INHIBITORS INCYTE CORPORATION 2023-06-29 US disclosed
WO-2023102184-A1 BICYCLIC AMINE COMPOUNDS AS CDK12 INHIBITORS INCYTE CORPORATION (US) 2023-06-08 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 (1 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-20230203010-A1 BICYCLIC AMINE CDK12 INHIBITORS CDK12, CDK1, CDK2 CCNK 17/4885CDK12 1/4885CCNA2 18/4885

“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.