SCHEMBL7258696

SCHEMBL7258696

CSCCC(NC(=O)c1ccc(-c2ccc(N(Cc3cncn3Cc3ccc(C#N)cc3)C(=O)c3cccc(F)c3)cc2)o1)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FNTA P49354 14/20 0.62
FNTB P49356 14/20 0.62
PGGT1B P53609 2/20 0.45
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41

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
SCHEMBL7256056 0.95 FNTA (0.63) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL7258722 0.82 FNTA (0.58) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL7259636 0.82 FNTA (0.64) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL7258745 0.82 FNTA (0.57) FNTAFNTBCYP11B1CYP11B2
SCHEMBL7260673 0.81 FNTA (0.49) FNTAFNTBPGGT1B
SCHEMBL7259787 0.80 FNTA (0.72) FNTAFNTBPGGT1B
SCHEMBL7258776 0.80 FNTA (0.55) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL7260733 0.79 FNTA (0.62) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL7255988 0.79 CYP11B1 (0.46) FNTAFNTBCYP11B1CYP11B2
SCHEMBL7255071 0.79 FNTA (0.48) FNTAFNTBPGGT1B

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