SCHEMBL7864465

SCHEMBL7864465

CSCC[C@H](NC(=O)c1cc(COC(Cn2ccnc2)c2ccc(F)cc2)ccc1CCc1ccc(F)cc1)C(=O)OC(C)(C)CN1CCOCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FNTA P49354 2/20 0.39
FNTB P49356 2/20 0.39
PGGT1B P53609 1/20 0.39
PTGS2 P35354 1/20 0.35
RAB9A P51151 1/20 0.33
IDO1 P14902 3/20 0.33
CYP3A4 P08684 3/20 0.32
CYP2C9 P11712 2/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
ALDH1A1 P00352 2/20 0.31
MAPT P10636 2/20 0.31
TDP1 Q9NUW8 2/20 0.31
MEN1 O00255 1/20 0.31
TP53 P04637 1/20 0.31
CYP1A2 P05177 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
KMT2A Q03164 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL8194789 0.87 FNTA (0.39) FNTAFNTBPGGT1BRAB9AMEN1
SCHEMBL8194792 0.86 FNTA (0.40) FNTAFNTBPGGT1BRAB9AMAPT
SCHEMBL7564412 0.85 FNTA (0.49) FNTAFNTBPGGT1BPTGS2IDO1
SCHEMBL7864468 0.84 PTGS2 (0.37) FNTAFNTBPGGT1BPTGS2IDO1
SCHEMBL7561955 0.79 FNTA (0.51) FNTAFNTBPTGS2IDO1CYP3A4
SCHEMBL7612438 0.79 FNTA (0.49) FNTAFNTBPTGS2IDO1
SCHEMBL7562597 0.76 FNTA (0.49) FNTAFNTBPGGT1BPTGS2CYP3A4
SCHEMBL7662187 0.74 FNTA (0.52) FNTAFNTBPGGT1BPTGS2CYP3A4
SCHEMBL7562577 0.74 FNTA (0.55) FNTAFNTBPTGS2
SCHEMBL7657859 0.73 FNTA (0.51) FNTAFNTBPGGT1BALDH1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1025088-B1 IMIDAZOLE DERIVATIVES AND THEIR USE AS FARNESYL PROTEIN TRANSFERASE INHIBITORS ASTRAZENECA AB (SE) 2001-09-05 EP claimed
EP-1025088-A1 IMIDAZOLE DERIVATIVES AND THEIR USE AS FARNESYL PROTEIN TRANSFERASE INHIBITORS AstraZeneca UK Limited (GB) 2000-08-09 EP disclosed
WO-1999020611-A1 IMIDAZOLE DERIVATIVES AND THEIR USE AS FARNESYL PROTEIN TRANSFERASE INHIBITORS ZENECA LIMITED (GB) 1999-04-29 WO disclosed