SCHEMBL8624850

SCHEMBL8624850

CSCC[C@H](NC(=O)c1cc([N+](=O)[O-])cc2ccccc12)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FNTA P49354 8/20 0.54
FNTB P49356 8/20 0.54
MAPT P10636 1/20 0.47
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
ALDH1A1 P00352 1/20 0.46
USP2 O75604 1/20 0.45
TSHR P16473 1/20 0.45
CA2 P00918 2/20 0.45
CA1 P00915 1/20 0.45

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
SCHEMBL8626201 0.90 FNTA (0.48) FNTAFNTBMAPTKMT2AMEN1
SCHEMBL8626764 0.89 FNTA (0.60) FNTAFNTBMAPTALDH1A1
SCHEMBL8623763 0.83 FNTA (0.57) FNTAFNTBKMT2AMEN1ALDH1A1
SCHEMBL9828951 0.81 FNTA (0.62) FNTAFNTBKMT2AMEN1ALDH1A1
SCHEMBL2324069 0.81 FNTA (0.62) FNTAFNTBKMT2AMEN1ALDH1A1
SCHEMBL8623835 0.81 FNTA (0.52) FNTAFNTBMAPTALDH1A1CA2
SCHEMBL8624885 0.80 FNTA (0.52) FNTAFNTBALDH1A1USP2TSHR
SCHEMBL6384342 0.80 FNTA (0.59) FNTAFNTBMAPTALDH1A1
SCHEMBL2330739 0.79 FNTA (0.53) FNTAFNTBALDH1A1USP2TSHR
SCHEMBL2330735 0.79 FNTA (0.53) FNTAFNTBALDH1A1USP2TSHR

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-0842150-A1 NOVEL FARNESYL TRANSFERASE INHIBITORS, PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAID INHIBITORS Aventis Pharma S.A. (FR) 1998-05-20 EP disclosed
EP-0764149-A1 NOVEL FARNESYL TRANSFERASE INHIBITORS, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME Aventis Pharma S.A. (FR) 1997-03-26 EP disclosed
WO-1997003047-A1 NOVEL FARNESYL TRANSFERASE INHIBITORS, PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAID INHIBITORS Rhône-Poulenc Rorer S.A. (FR) 1997-01-30 WO disclosed
WO-1995034535-A1 NOVEL FARNESYL TRANSFERASE INHIBITORS, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME RHONE-POULENC RORER S.A. (FR) 1995-12-21 WO disclosed