SCHEMBL7258737

SCHEMBL7258737

N#Cc1ccc(Cn2cncc2Cc2ccc(C(N)=O)c(-c3ccc(C(=O)N4CCSCC4)o3)c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 4/20 0.42
CYP11B2 P19099 4/20 0.42
FNTA P49354 14/20 0.42
FNTB P49356 14/20 0.42
PGGT1B P53609 12/20 0.41
KCNH2 Q12809 2/20 0.40

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
SCHEMBL7259664 0.92 CYP11B1 (0.43) CYP11B1CYP11B2FNTAFNTBPGGT1B
SCHEMBL7258738 0.81 FNTA (0.49) CYP11B1CYP11B2FNTAFNTBPGGT1B
SCHEMBL7258735 0.79 FNTA (0.52) FNTAFNTBPGGT1BKCNH2
SCHEMBL7255082 0.77 FNTA (0.49) CYP11B1CYP11B2FNTAFNTBPGGT1B
SCHEMBL7259745 0.76 FNTA (0.40) CYP11B1CYP11B2FNTAFNTBPGGT1B
SCHEMBL7255190 0.75 FNTA (0.49) CYP11B1CYP11B2FNTAFNTBPGGT1B
SCHEMBL6986650 0.70 CYP11B1 (0.54) CYP11B1CYP11B2FNTAFNTBPGGT1B
SCHEMBL6754966 0.68 FNTA (0.48) FNTAFNTBPGGT1BKCNH2
SCHEMBL6985655 0.68 CYP11B1 (0.50) CYP11B1CYP11B2FNTAFNTBPGGT1B
SCHEMBL6756369 0.67 FNTA (0.49) FNTAFNTBPGGT1BKCNH2

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-2003099812-A1 PHENYL-FURAN OR PHENYL-THIOPHENE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS MEDICINE PIERRE FABRE MEDICAMENT (FR) 2003-12-04 WO disclosed