SCHEMBL6180669

SCHEMBL6180669

CC(c1ccccc1)N1CCN(C(=O)NC2CCCCC2)[C@@H](C(=O)NCCc2cncn2Cc2ccc(C#N)cc2)C1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FNTA P49354 18/20 0.46
FNTB P49356 18/20 0.46
PGGT1B P53609 13/20 0.46
CYP11B1 P15538 2/20 0.42
CYP11B2 P19099 2/20 0.42
KCNH2 Q12809 1/20 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
SCHEMBL7679202 0.85 FNTA (0.48) FNTAFNTBPGGT1BKCNH2
SCHEMBL7682555 0.83 ACKR3 (0.40) FNTAFNTB
SCHEMBL6179814 0.83 FNTA (0.46) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL8097922 0.83 FNTA (0.51) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL8444169 0.83 FNTA (0.51) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL7682279 0.79 FNTA (0.49) FNTAFNTB
SCHEMBL8097935 0.77 FNTA (0.52) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL7679247 0.77 FNTA (0.50) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL7682332 0.76 FNTA (0.47) FNTAFNTB
SCHEMBL8098229 0.76 FNTA (0.53) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1140909-B1 NOVEL INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE SCHERING CORP (US) 2005-07-06 EP disclosed
US-6432959-B1 ANTITUMOR AGENTS SCHERING CORPORATION 2002-08-13 US disclosed
EP-1140909-A1 NOVEL INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE SCHERING CORPORATION (US) 2001-10-10 EP disclosed
WO-2000039119-A1 NOVEL INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE SCHERING CORPORATION (US) 2000-07-06 WO disclosed