SCHEMBL8499641

SCHEMBL8499641

CC(C)(CNC(=O)CN(CCc1ccc(OCc2ccccc2)cc1)C(=O)C(Cc1cnc[nH]1)NC(=O)OCc1ccccc1)c1ccccc1

nearest known ligand 0.87

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HRAS P01112 12/20 0.87
FNTA P49354 1/20 0.66
FNTB P49356 1/20 0.66
LTA4H P09960 1/20 0.42
MMP3 P08254 1/20 0.41
S1PR1 P21453 1/20 0.41

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
SCHEMBL7649727 1.00 HRAS (0.87) HRASFNTAFNTBLTA4HMMP3
SCHEMBL7654412 0.94 HRAS (0.78) HRASFNTAFNTBMMP3
SCHEMBL7648622 0.93 HRAS (1.00) HRASFNTAFNTBLTA4H
SCHEMBL6842134 0.93 HRAS (1.00) HRASFNTAFNTBLTA4H
SCHEMBL7654209 0.91 HRAS (0.95) HRASFNTAFNTB
SCHEMBL7655180 0.89 HRAS (0.92) HRASFNTAFNTBLTA4H
SCHEMBL7653253 0.89 HRAS (0.92) HRASFNTAFNTB
SCHEMBL7860387 0.89 HRAS (0.92) HRASFNTAFNTB
SCHEMBL6810001 0.89 HRAS (0.77) HRASFNTAFNTBMMP3
SCHEMBL7860400 0.88 HRAS (0.87) HRASFNTAFNTB

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-0938494-A1 INHIBITORS OF PROTEIN FARNESYL TRANSFERASE WARNER-LAMBERT COMPANY (US) 1999-09-01 EP claimed
WO-1997044350-A1 INHIBITORS OF PROTEIN FARNESYL TRANSFERASE WARNER-LAMBERT COMPANY (US) 1997-11-27 WO claimed
EP-0938494-A1 INHIBITORS OF PROTEIN FARNESYL TRANSFERASE WARNER-LAMBERT COMPANY (US) 1999-09-01 EP disclosed
WO-1997044350-A1 INHIBITORS OF PROTEIN FARNESYL TRANSFERASE WARNER-LAMBERT COMPANY (US) 1997-11-27 WO disclosed