SCHEMBL8199698

SCHEMBL8199698

CSCC[C@H](NC(=O)c1cccc(C=C(Cc2ncc[nH]2)c2nccs2)c1)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FNTA P49354 17/20 0.46
FNTB P49356 17/20 0.46
PGGT1B P53609 4/20 0.46
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
USP2 O75604 1/20 0.39
ALDH1A1 P00352 1/20 0.39
TP53 P04637 1/20 0.39
ALOX15 P16050 1/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL8207365 0.91 FNTA (0.40) FNTAFNTBPGGT1BMEN1KMT2A
SCHEMBL8207251 0.88 MRGPRX4 (0.38) FNTAFNTBPGGT1B
SCHEMBL8198280 0.86 FNTA (0.46) FNTAFNTBPGGT1BUSP2ALDH1A1
SCHEMBL8206389 0.86 FNTA (0.46) FNTAFNTBPGGT1BUSP2ALDH1A1
SCHEMBL8206498 0.86 FNTA (0.41) FNTAFNTBPGGT1B
SCHEMBL8206261 0.84 FNTA (0.51) FNTAFNTB
SCHEMBL8199451 0.82 FNTA (0.43) FNTAFNTB
SCHEMBL8206449 0.82 FNTA (0.45) FNTAFNTB
SCHEMBL8212186 0.81 FNTA (0.44) FNTAFNTBPGGT1BUSP2ALDH1A1
SCHEMBL8212192 0.81 FNTA (0.44) FNTAFNTBPGGT1BUSP2ALDH1A1

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
EP-0975603-A1 INHIBITORS OF FARNESYL PROTEIN TRANSFERASE ZENECA LIMITED (GB) 2000-02-02 EP disclosed
WO-1998032741-A1 INHIBITORS OF FARNESYL PROTEIN TRANSFERASE ZENECA LIMITED (GB) 1998-07-30 WO disclosed