SCHEMBL7528336

SCHEMBL7528336

CCOc1ccccc1COC(=O)N1CCN(Cc2cnc(C)n2Cc2ccc(C#N)cc2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FNTA P49354 19/20 1.00
FNTB P49356 19/20 1.00
PGGT1B P53609 19/20 1.00
ALDH1A1 P00352 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
SCHEMBL7650227 0.90 FNTA (1.00) FNTAFNTBPGGT1B
SCHEMBL7464345 0.90 FNTA (0.81) FNTAFNTBPGGT1B
SCHEMBL7655474 0.88 FNTA (0.83) FNTAFNTBPGGT1B
SCHEMBL7465329 0.86 FNTA (0.81) FNTAFNTBPGGT1B
SCHEMBL7463172 0.84 FNTA (0.77) FNTAFNTBPGGT1B
SCHEMBL7464811 0.84 FNTA (0.77) FNTAFNTBPGGT1B
SCHEMBL7468247 0.81 FNTA (0.69) FNTAFNTBPGGT1B
SCHEMBL7594023 0.77 FNTA (1.00) FNTAFNTBPGGT1B
SCHEMBL7652714 0.76 FNTA (0.83) FNTAFNTBPGGT1B
SCHEMBL7589808 0.75 FNTA (1.00) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1165082-A4 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO INC (US) 2002-06-12 EP disclosed
US-6358956-B1 IMIDAZOLYLALKYL-1-PIPERAZINE DERIVATIVES; FARNESYL-PROTEIN AND GERANYLGERANYL TRANSFERASE INHIBITORS; ANTICARCINOGENIC AGENTS MERCK & CO., INC. 2002-03-19 US disclosed
EP-1165082-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 2002-01-02 EP disclosed
WO-2000051611-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2000-09-08 WO disclosed