SCHEMBL7573772

SCHEMBL7573772

Cc1oc2ccc(C(N)=O)c(Cn3ccnc3)c2c1C

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 9/20 0.46
CYP11B1 P15538 6/20 0.46
CYP11B2 P19099 6/20 0.46
CYP19A1 P11511 5/20 0.44
ATM Q13315 1/20 0.38

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
SCHEMBL2352944 0.81 CYP19A1 (0.62) TBXAS1CYP11B1CYP11B2CYP19A1ATM
Hydrochloric Acid SCHEMBL9844004 0.80 CYP19A1 (0.61) TBXAS1CYP11B1CYP11B2CYP19A1ATM
SCHEMBL27735896 0.70 TBXAS1 (0.50) TBXAS1CYP11B1CYP11B2CYP19A1
SCHEMBL7573780 0.70 TAAR1 (0.43) TBXAS1
SCHEMBL9843746 0.68 CYP19A1 (0.57) TBXAS1CYP11B1CYP11B2CYP19A1
SCHEMBL9843743 0.67 CYP19A1 (0.56) TBXAS1CYP11B1CYP11B2CYP19A1
SCHEMBL395505 0.67 CYP11B1 (0.96) TBXAS1CYP11B1CYP11B2CYP19A1
SCHEMBL15722807 0.67 CYP11B1 (0.88) TBXAS1CYP11B1CYP11B2CYP19A1
SCHEMBL10947848 0.66 TBXAS1 (0.81) TBXAS1CYP11B1CYP11B2CYP19A1
SCHEMBL28975968 0.65 CYP11B1 (1.00) TBXAS1CYP11B1CYP11B2CYP19A1

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-2002083146-A1 MULTIPLE DOSE AROMATASE INHIBITOR FOR TREATING INFERTILITY ARES TRADING S.A. (CH) 2002-10-24 WO disclosed