SCHEMBL8008699

SCHEMBL8008699

CCc1c(-c2ccc(OC)cc2)n[nH]c1-c1ccc(OC)cc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.50
MEN1 O00255 1/20 0.50
CDK4 P11802 7/20 0.49
CCND1 P24385 6/20 0.49
CDK2 P24941 5/20 0.49
CCNE2 O96020 4/20 0.49
CCNE1 P24864 4/20 0.49
HTT P42858 1/20 0.46
MAPK10 P53779 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
KDM4E B2RXH2 1/20 0.45
GAPDH P04406 1/20 0.45
MAPT P10636 1/20 0.45
PDGFRB P09619 1/20 0.44
KIT P10721 1/20 0.44
ALPL P05186 1/20 0.44
TGFBR1 P36897 1/20 0.43
DYRK1B Q9Y463 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
SCHEMBL5216372 0.81 CDK4 (0.50) KMT2AMEN1CDK4CCND1CDK2
SCHEMBL5218883 0.80 PDPK1 (0.45) CDK2DYRK1B
SCHEMBL19923002 0.80 ALDH1A1 (0.51) HTTMAPK10SMN1; SMN2KDM4EMAPT
SCHEMBL12567890 0.80 ALDH1A1 (0.55) HTTMAPK10SMN1; SMN2KDM4EMAPT
SCHEMBL22784037 0.74 CCNE2 (0.46) KMT2AMEN1CDK4CCND1CDK2
SCHEMBL8020401 0.73 MAPT (0.67) KMT2AMEN1CDK4CCND1CDK2
SCHEMBL22774907 0.72 CCNE2 (0.45) KMT2AMEN1CDK4CCND1CDK2
SCHEMBL17279838 0.72 ALDH1A1 (0.46) CDK2MAPK10SMN1; SMN2KDM4EMAPT
SCHEMBL8890557 0.72 SMN1; SMN2 (0.53) KMT2AMEN1CDK4CCND1CDK2
SCHEMBL28102260 0.72 MAPT (0.56) KMT2AMEN1CDK4CCND1CDK2

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-2000019994-A1 ESTROGEN RECEPTOR LIGANDS BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2000-04-13 WO disclosed