Sugi Predict

Sugi Predict / Compounds / SCHEMBL8494787

SCHEMBL8494787

SCHEMBL8494787

Cc1ccc(NC(=S)N(CC(C)(C)C(=O)Cc2cncn2Cc2ccc(C#N)cc2)NCc2cccc(Cl)c2Cl)cc1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ FNTA P49354 11/20 0.40
▸ FNTB P49356 11/20 0.40
▸ PGGT1B P53609 7/20 0.40
▸ CYP11B1 P15538 3/20 0.39
▸ CYP11B2 P19099 3/20 0.39
▸ KCNH2 Q12809 1/20 0.37

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
SCHEMBL8494797 0.83 FNTA (0.39) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL8494800 0.82 CYP11B1 (0.40) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL8495101 0.81 FNTA (0.39) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL8500957 0.78 FNTA (0.41) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL8497691 0.78 FNTA (0.39) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL7086062 0.77 CYP11B1 (0.47) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL8499175 0.76 CYP11B1 (0.41) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL8606558 0.76 FNTA (0.41) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL8492539 0.76 CYP11B1 (0.39) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL8582438 0.76 FNTA (0.40) FNTAFNTBPGGT1BCYP11B1CYP11B2

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