SCHEMBL8106726

SCHEMBL8106726

N[C@@H](CS)CNCc1cccc(-c2cccc(C(=O)O)c2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FNTA P49354 10/20 1.00
FNTB P49356 10/20 1.00
PGGT1B P53609 9/20 1.00
ANPEP P15144 2/20 0.58
ENPEP Q07075 2/20 0.58
CFD P00746 1/20 0.47
MEP1B Q16820 1/20 0.47

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
SCHEMBL8111003 0.82 FNTA (1.00) FNTAFNTBPGGT1BANPEPENPEP
SCHEMBL8097474 0.79 FNTA (1.00) FNTAFNTBPGGT1BANPEPENPEP
SCHEMBL8586902 0.79 FNTA (1.00) FNTAFNTBPGGT1BANPEPENPEP
SCHEMBL1252499 0.72 CFD (0.66) FNTAFNTBPGGT1BCFD
SCHEMBL31370223 0.72 GRIA2 (0.71) FNTAFNTBANPEPENPEP
SCHEMBL7996862 0.71 FNTA (0.56) FNTAFNTBPGGT1BANPEPENPEP
SCHEMBL7994759 0.71 FNTA (0.56) FNTAFNTBPGGT1BANPEPENPEP
SCHEMBL5862921 0.71 CA1 (0.61) FNTAFNTBPGGT1BMEP1B
SCHEMBL29276453 0.71 KMO (0.83)
SCHEMBL5519447 0.70 KMO (0.63) 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
US-6011175-A Inhibition of farnesyltransferase UNIVERSITY OF PITTSBURGH (US) 2000-01-04 US disclosed
US-5965539-A PEPTIDOMIMETICS; ANTI-CANCER DRUGS UNIVERISTY OF PITTSBURGH (US) 1999-10-12 US disclosed
EP-0794789-A4 INHIBITORS OF PRENYL TRANSFERASES UNIV PITTSBURGH (US) 1999-05-26 EP disclosed
EP-0794789-A1 INHIBITORS OF PRENYL TRANSFERASES UNIVERSITY OF PITTSBURGH (US) 1997-09-17 EP disclosed