SCHEMBL7971483

SCHEMBL7971483

COC(=O)C1(Cc2ccc(Cl)cc2)CCN(C(=O)Cc2cncn2Cc2ccc(C#N)cc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 5/20 0.52
CYP11B2 P19099 5/20 0.52
FNTA P49354 13/20 0.49
FNTB P49356 13/20 0.49
PGGT1B P53609 11/20 0.49
ALDH1A1 P00352 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL7849345 0.91 CYP11B1 (0.47) CYP11B1CYP11B2FNTAFNTBPGGT1B
SCHEMBL7831475 0.90 FNTA (0.51) CYP11B1CYP11B2FNTAFNTBPGGT1B
SCHEMBL7848326 0.87 FNTA (0.50) CYP11B1CYP11B2FNTAFNTBPGGT1B
SCHEMBL7960820 0.87 FNTA (0.49) CYP11B1CYP11B2FNTAFNTBPGGT1B
SCHEMBL7973044 0.87 FNTA (0.56) CYP11B1CYP11B2FNTAFNTBPGGT1B
SCHEMBL7970850 0.85 FNTA (0.57) CYP11B1CYP11B2FNTAFNTBPGGT1B
SCHEMBL7839747 0.84 FNTA (0.59) CYP11B1CYP11B2FNTAFNTBPGGT1B
SCHEMBL7832250 0.83 FNTA (0.58) CYP11B1CYP11B2FNTAFNTBPGGT1B
SCHEMBL7829982 0.79 FNTA (0.57) CYP11B1CYP11B2FNTAFNTBPGGT1B
SCHEMBL7840500 0.79 FNTA (0.57) CYP11B1CYP11B2FNTAFNTBPGGT1B

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
US-6248756-B1 Inhibitors of farnesyl-protein transferase MERCK & CO., INC. 2001-06-19 US disclosed
US-5891889-A Inhibitors of farnesyl-protein transferase MERCK & CO., INC. (US) 1999-04-06 US disclosed