SCHEMBL8307560

SCHEMBL8307560

N#Cc1ccc(Cc2cnc(Cc3cc(Cl)c(-c4ccccc4)cn3)[nH]2)cc1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BRS3 P32247 14/20 0.54
CYP11B1 P15538 2/20 0.38
CYP11B2 P19099 2/20 0.38
HRH3 Q9Y5N1 1/20 0.38
CSNK2A2 P19784 1/20 0.35
CSNK2B P67870 1/20 0.35
CSNK2A1 P68400 1/20 0.35
CSNK2A3 Q8NEV1 1/20 0.35
AOC3 Q16853 1/20 0.34

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 SCHEMBL8522033 0.99 BRS3 (0.53) BRS3CYP11B1CYP11B2HRH3CSNK2A2
SCHEMBL7919373 0.87 BRS3 (0.56) BRS3CYP11B1CYP11B2HRH3CSNK2A2
Bromide SCHEMBL8310757 0.86 BRS3 (0.55) BRS3CYP11B1CYP11B2HRH3CSNK2A2
SCHEMBL8303912 0.84 BRS3 (0.55) BRS3CYP11B1CYP11B2HRH3AOC3
Hydrochloric Acid SCHEMBL8303557 0.83 BRS3 (0.54) BRS3CYP11B1CYP11B2HRH3AOC3
SCHEMBL8308371 0.81 BRS3 (0.56) BRS3CYP11B1CYP11B2HRH3AOC3
SCHEMBL7927590 0.81 BRS3 (0.61) BRS3HRH3
SCHEMBL7919393 0.81 BRS3 (0.62) BRS3CYP11B1CYP11B2HRH3AOC3
Hydrochloric Acid SCHEMBL8304730 0.81 BRS3 (0.55) BRS3CYP11B1CYP11B2HRH3AOC3
SCHEMBL7927535 0.80 BRS3 (0.52) BRS3CYP11B1CYP11B2HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0891361-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 1999-01-20 EP claimed
WO-1997036901-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1997-10-09 WO claimed
EP-0891361-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 1999-01-20 EP disclosed
WO-1997036901-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1997-10-09 WO disclosed