SCHEMBL8584352

SCHEMBL8584352

CCC(CN(Cc1ccccc1C(F)(F)F)C(=S)Nc1ccccc1F)NC(=O)Cc1cncn1Cc1ccc(C#N)cc1

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FNTA P49354 11/20 0.40
FNTB P49356 11/20 0.40
CYP11B1 P15538 5/20 0.39
CYP11B2 P19099 5/20 0.39
PGGT1B P53609 7/20 0.39

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
SCHEMBL8584354 1.00 FNTA (0.40) FNTAFNTBCYP11B1CYP11B2PGGT1B
SCHEMBL8498038 0.94 FNTA (0.39) FNTAFNTBCYP11B1CYP11B2PGGT1B
SCHEMBL8492544 0.94 CYP11B1 (0.39) FNTAFNTBCYP11B1CYP11B2PGGT1B
SCHEMBL8489740 0.92 FNTA (0.39) FNTAFNTBCYP11B1CYP11B2PGGT1B
SCHEMBL8612198 0.92 FNTA (0.42) FNTAFNTBCYP11B1CYP11B2PGGT1B
SCHEMBL8490273 0.91 FNTA (0.42) FNTAFNTBCYP11B1CYP11B2PGGT1B
SCHEMBL8488145 0.90 CYP11B1 (0.41) FNTAFNTBCYP11B1CYP11B2PGGT1B
SCHEMBL8488149 0.90 CYP11B1 (0.41) FNTAFNTBCYP11B1CYP11B2PGGT1B
SCHEMBL8493225 0.90 FNTA (0.39) FNTAFNTBCYP11B1CYP11B2PGGT1B
SCHEMBL8495036 0.90 CYP11B1 (0.39) FNTAFNTBCYP11B1CYP11B2PGGT1B

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-1999012912-A1 THIOUREA DERIVATIVES OR NON-TOXIC SALTS THEREOF FOR INHIBITNG RAS-TRANSFORMED CELL GROWTH YUHAN CORPORATION (KR) 1999-03-18 WO disclosed