SCHEMBL31390992

SCHEMBL31390992

Cn1ccc(-c2ccnc(Cl)n2)n1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
JMJD6 Q6NYC1 11/20 0.45
MAPK10 P53779 1/20 0.43
KMT2A Q03164 1/20 0.41
DYRK1A Q13627 1/20 0.41
KEAP1 Q14145 1/20 0.39
GABRA1 P14867 1/20 0.38
GABRG2 P18507 1/20 0.38
GABRB3 P28472 1/20 0.38
GABRA3 P34903 1/20 0.38
KDM5B Q9UGL1 2/20 0.38
KDM4A O75164 1/20 0.37
KDM4B O94953 1/20 0.37
SCN4A P35499 1/20 0.37
CYP19A1 P11511 1/20 0.36

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
SCHEMBL31391001 1.00 JMJD6 (0.45) JMJD6MAPK10KMT2ADYRK1AKEAP1
SCHEMBL18171776 0.79 GABRA1 (0.41) MAPK10KMT2AGABRA1GABRG2GABRB3
SCHEMBL18157906 0.74 KMT2A (0.64) JMJD6KMT2AKEAP1KDM5BKDM4A
SCHEMBL23119743 0.74 JMJD6 (0.57) JMJD6KMT2AKEAP1KDM5BKDM4A
SCHEMBL25219200 0.74 JMJD6 (0.45) JMJD6KMT2AKEAP1KDM5BKDM4A
SCHEMBL30448134 0.74 JMJD6 (0.45) JMJD6KMT2AKEAP1KDM5BKDM4A
SCHEMBL2684263 0.74 KMO (0.35) GABRA1GABRG2GABRB3GABRA3
SCHEMBL22121738 0.74 ACVR1 (0.41) JMJD6MAPK10KMT2ADYRK1AKEAP1
SCHEMBL17339152 0.73 CCNC (0.38) KMT2AGABRA1GABRG2GABRB3GABRA3
SCHEMBL20987177 0.73 DYRK1A (0.53) DYRK1AGABRA1GABRG2GABRB3GABRA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025067457-A1 HETEROCYCLIC FUSED RING COMPOUND, AND COMPOSITION AND USE THEREOF 深圳市塔吉瑞生物医药有限公司 2025-04-03 WO disclosed