SCHEMBL9525697

SCHEMBL9525697

c1cc2ccc3nncc3c2[nH]n1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK10 P53779 1/20 0.34
CDK2 P24941 8/20 0.32
CCNA2 P20248 7/20 0.32
CCNA1 P78396 7/20 0.32
AURKA O14965 1/20 0.30
CDK1 P06493 1/20 0.30
AURKB Q96GD4 1/20 0.30

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
SCHEMBL2122482 0.76 CCNA2 (0.32) CDK2CCNA2CCNA1
SCHEMBL10535479 0.75 MAPT (0.40) CDK2AURKA
SCHEMBL427782 0.71 AHR (0.36) CDK2CCNA2CCNA1
SCHEMBL1133642 0.71 CCNA2 (0.34) CDK2CCNA2CCNA1
SCHEMBL29941234 0.70 MAPK10 (0.45) MAPK10CDK2CCNA2CCNA1
SCHEMBL167198 0.68 CCNA2 (0.31) CDK2CCNA2CCNA1
SCHEMBL18222106 0.67 NPC1 (0.38) CDK2CCNA2CCNA1CDK1
SCHEMBL17491129 0.66 CCNB2 (0.42) CDK2CCNA2CCNA1CDK1
SCHEMBL12276833 0.66 CCNA2 (0.33) CDK2CCNA2CCNA1
SCHEMBL1395066 0.66 TGFBR1 (0.36) CDK2CCNA2CCNA1

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
EP-4642784-A1 HETEROCYCLIC AND HETEROARYL COMPOUNDS AS INHIBITORS OF NLRP3 PTC Therapeutics, Inc. (US) 2025-11-05 EP disclosed
WO-2024145623-A1 HETEROCYCLIC AND HETEROARYL COMPOUNDS AS INHIBITORS OF NLRP3 PTC THERAPEUTICS, INC. (US) 2024-07-04 WO disclosed
EP-0277791-B1 CINNOLINE-CARBOXAMIDES AND PROCESS FOR THEIR PREPARATION FARMITALIA CARLO ERBA S.r.l. (IT) 1993-06-02 EP disclosed
US-4826837-A IMMUNOMODULATORS FARMITALIA CARLO ERBA S.R.L. (IT) 1989-05-02 US disclosed
EP-0277791-A2 Cinnoline-carboxamides and process for their preparation FARMITALIA CARLO ERBA S.r.l. (IT) 1988-08-10 EP disclosed