SCHEMBL23978180

SCHEMBL23978180

CN/C(C)=C(/NCc1cnc(Cl)nc1Nc1ccc(OC)cn1)C(C)=N

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.33
KIT P10721 1/20 0.33
JAK1 P23458 1/20 0.33
TYK2 P29597 1/20 0.33
KCNH2 Q12809 1/20 0.33
CCND3 P30281 1/20 0.31
CDK6 Q00534 1/20 0.31
TRPV4 Q9HBA0 1/20 0.31
MAPKAPK2 P49137 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
SCHEMBL23978366 0.76
SCHEMBL30309599 0.71 LCK (0.41) CCND3CDK6
SCHEMBL23978358 0.71 LCK (0.41) CCND3CDK6
SCHEMBL30309493 0.71 CYP1A2 (0.39) CCND3CDK6TRPV4
SCHEMBL30309501 0.71 CCND3 (0.36) CCND3CDK6TRPV4
SCHEMBL30309547 0.71 TRPV4 (0.38) CCND3CDK6TRPV4
SCHEMBL23978116 0.71 TRPV4 (0.38) CCND3CDK6TRPV4
SCHEMBL23978179 0.71 CCND3 (0.36) CCND3CDK6TRPV4
SCHEMBL23978363 0.71 CYP1A2 (0.39) CCND3CDK6TRPV4
SCHEMBL25886882 0.71 CCND3 (0.33) CCND3CDK6TRPV4

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-2021219731-A2 BICYCLIC KINASE INHIBITORS AND USES THEREOF IOMX THERAPEUTICS AG (DE) 2021-11-04 WO disclosed