SCHEMBL9119601

SCHEMBL9119601

Fc1ccc(C(CCCc2c[nH]cn2)c2ccc(F)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 18/20 0.54
SCN5A Q14524 1/20 0.38
FAAH O00519 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
TSHR P16473 1/20 0.36
ALOX12 P18054 1/20 0.36
MAPK1 P28482 1/20 0.36
MTOR P42345 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL9122689 0.96 CYP19A1 (0.56) CYP19A1CYP3A4CYP2D6MAPK1MTOR
SCHEMBL9728051 0.91 CYP19A1 (0.51) CYP19A1
SCHEMBL9728037 0.87 CYP19A1 (0.55) CYP19A1
SCHEMBL9119383 0.86 CYP19A1 (0.43) CYP19A1
SCHEMBL9120192 0.85 CYP19A1 (0.54) CYP19A1
SCHEMBL9120327 0.85 CYP19A1 (0.54) CYP19A1
SCHEMBL9122156 0.81 HRH1 (0.42) CYP19A1
SCHEMBL9119587 0.81 CYP19A1 (0.49) CYP19A1MAPK1
SCHEMBL9120034 0.81 CYP19A1 (0.50) CYP19A1
SCHEMBL9092229 0.81 CYP19A1 (0.56) CYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0390558-B1 Aromatase inhibiting 4(5)-imidazoles ORION YHTYMAE OY (FI) 1994-09-07 EP claimed
EP-0390558-A1 Aromatase inhibiting 4(5)-imidazoles ORION-YHTYMÀ„ OY (FI) 1990-10-03 EP claimed
US-5439928-A Enzyme inhibitors as antitumor agents for breast cancer ORION-YHTYMA OY (FI) 1995-08-08 US disclosed
EP-0390558-B1 Aromatase inhibiting 4(5)-imidazoles ORION YHTYMAE OY (FI) 1994-09-07 EP disclosed
EP-0390558-A1 Aromatase inhibiting 4(5)-imidazoles ORION-YHTYMÀ„ OY (FI) 1990-10-03 EP disclosed