SCHEMBL11230231

SCHEMBL11230231

Cc1ccc2c(c1)C(=O)C(n1ccnc1)CO2

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 12/20 0.48
MEN1 O00255 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
KMT2A Q03164 1/20 0.37
ALOX15 P16050 1/20 0.35
ALOX12 P18054 1/20 0.35
MAOB P27338 1/20 0.34
PIK3CA P42336 1/20 0.33
PIK3CB P42338 1/20 0.33
PIK3CG P48736 1/20 0.33
ADRA2A P08913 1/20 0.33

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
SCHEMBL10894568 0.86 CYP19A1 (0.49) CYP19A1MAOBPIK3CAPIK3CBPIK3CG
SCHEMBL11241082 0.85 CYP19A1 (0.48) CYP19A1MEN1KMT2AMAOBPIK3CA
SCHEMBL11231299 0.85 CYP19A1 (0.45) CYP19A1ALOX12MAOB
SCHEMBL11232796 0.84 CYP19A1 (0.51) CYP19A1KMT2AMAOB
SCHEMBL10893708 0.84 CYP19A1 (0.54) CYP19A1MEN1KMT2AALOX15ALOX12
Hydrochloric Acid SCHEMBL11236478 0.84 CYP19A1 (0.47) CYP19A1MEN1KMT2AMAOBPIK3CA
Bromide SCHEMBL11239402 0.84 CYP19A1 (0.44) CYP19A1ALOX12MAOB
SCHEMBL11239544 0.82 TBXAS1 (0.45) CYP19A1
SCHEMBL11230658 0.82 CYP19A1 (0.40) CYP19A1MEN1KMT2AALOX15ADRA2A
SCHEMBL11237227 0.82 TERT (0.39) CYP19A1MAOBPIK3CAPIK3CBPIK3CG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4342775-A FOR USE AS ANTICOAGULANT AND REDUCING SERUM SHOLESTEROL OR SERUM TRIGLYCERIDES FARMITALIA CARLO ERBA S.P.A. (IT) 1982-08-03 US claimed
US-4342775-A FOR USE AS ANTICOAGULANT AND REDUCING SERUM SHOLESTEROL OR SERUM TRIGLYCERIDES FARMITALIA CARLO ERBA S.P.A. (IT) 1982-08-03 US disclosed