SCHEMBL8148658

SCHEMBL8148658

N#Cc1ccc(C(Cc2ccc(-n3cc(Br)cc(Br)c3=O)nc2)c2ncc[nH]2)cc1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 1/20 0.32
CYP19A1 P11511 4/20 0.31
CNR2 P34972 1/20 0.30

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
Hydrochloric Acid SCHEMBL8150627 0.99 EGLN1 (0.32) EGLN1CYP19A1CNR2
SCHEMBL8157295 0.88 EGLN1 (0.33) EGLN1CYP19A1
SCHEMBL8156812 0.87 CYP19A1 (0.31) EGLN1CYP19A1
Hydrochloric Acid SCHEMBL8150165 0.86 CYP19A1 (0.31) EGLN1CYP19A1
SCHEMBL8149036 0.84 EGLN1 (0.33) EGLN1CYP19A1
SCHEMBL8149818 0.84 EGLN1 (0.35) EGLN1CYP19A1
SCHEMBL8156634 0.81 S1PR1 (0.33) EGLN1CYP19A1
SCHEMBL8151901 0.80 CYP19A1 (0.34) EGLN1CYP19A1
Hydrochloric Acid SCHEMBL8148673 0.80 S1PR1 (0.33) EGLN1CYP19A1
SCHEMBL8142506 0.79 CYP19A1 (0.38) EGLN1CYP19A1

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
US-6077853-A Inhibitors of farnesyl-protein transferase MERCK & CO., INC. (US) 2000-06-20 US disclosed