SCHEMBL7140772

SCHEMBL7140772

COc1ccc(-c2n[nH]c3c2C(=O)c2ccccc2-3)cc1OC

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 11/20 0.70
CCND1 P24385 10/20 0.70
CDK2 P24941 8/20 0.70
CCNE2 O96020 7/20 0.70
CCNE1 P24864 7/20 0.70
PDE4A P27815 2/20 0.59
PDE4B Q07343 2/20 0.59
PDE4C Q08493 2/20 0.59
PDE4D Q08499 2/20 0.59
KDM4E B2RXH2 1/20 0.49
MEN1 O00255 1/20 0.49
USP2 O75604 1/20 0.49
ALDH1A1 P00352 1/20 0.49
MAPT P10636 1/20 0.49
DUSP3 P51452 1/20 0.49
KMT2A Q03164 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
ADORA1 P30542 1/20 0.48
CHEK1 O14757 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.46

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
SCHEMBL7147568 0.87 CDK4 (0.67) CDK4CCND1CDK2CCNE2CCNE1
SCHEMBL7090323 0.81 PDE4A (0.49) CDK4CCND1CDK2CCNE2CCNE1
SCHEMBL7090322 0.81 PDE4A (0.49) CDK4CCND1CDK2CCNE2CCNE1
SCHEMBL4024853 0.79 CCNE2 (0.76) CDK4CCND1CDK2CCNE2CCNE1
SCHEMBL7090159 0.77 CDK4 (0.71) CDK4CCND1CDK2CCNE2CCNE1
SCHEMBL7091188 0.76 CCNE2 (0.69) CDK4CCND1CDK2CCNE2CCNE1
SCHEMBL7145484 0.75 CDK4 (0.68) CDK4CCND1CDK2CCNE2CCNE1
SCHEMBL4816704 0.75 CDK4 (0.68) CDK4CCND1CDK2CCNE2CCNE1
SCHEMBL7146443 0.75 CDK4 (0.68) CDK4CCND1CDK2CCNE2CCNE1
SCHEMBL6477699 0.74 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DKDM4E

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
US-6534655-B1 Administering as anti-angiogenic compounds or to inhibit vascular hyperpermeability BASF AKTIENGESELLSCHAFT (DE) 2003-03-18 US disclosed
EP-1021182-A1 INDENO[1,2-C] PYRAZOLE DERIVATIVES FOR INHIBITING TYROSINE KINASE ACTIVITY BASF AKTIENGESELLSCHAFT (DE) 2000-07-26 EP disclosed
WO-1999017770-A1 INDENO[1,2-C]PYRAZOLE DERIVATIVES FOR INHIBITING TYROSINE KINASE ACTIVITY BASF AKTIENGESELLSCHAFT (DE) 1999-04-15 WO disclosed