SCHEMBL7709327

SCHEMBL7709327

CSCC[C@H](NC(=O)c1cccc(C=C(Cn2ccnc2)c2ccc(F)cc2)c1)C(=O)NS(=O)(=O)C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.43
KMT2A Q03164 1/20 0.36
FNTA P49354 2/20 0.36
FNTB P49356 2/20 0.36
AGTR2 P50052 4/20 0.36
CYP3A4 P08684 1/20 0.35
CYP2C19 P33261 1/20 0.35
CYP19A1 P11511 2/20 0.35
CYP51A1 Q16850 3/20 0.35

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
SCHEMBL7709325 1.00 RAB9A (0.43) RAB9AKMT2AFNTAFNTBAGTR2
SCHEMBL7706109 0.88 FNTA (0.46) RAB9AFNTAFNTBAGTR2CYP3A4
SCHEMBL7703276 0.88 FNTA (0.46) RAB9AFNTAFNTBAGTR2CYP3A4
SCHEMBL7703271 0.88 FNTA (0.46) RAB9AFNTAFNTBAGTR2CYP3A4
SCHEMBL8206537 0.88 FNTA (0.46) RAB9AFNTAFNTBAGTR2CYP3A4
SCHEMBL7706112 0.88 FNTA (0.46) RAB9AFNTAFNTBAGTR2CYP3A4
SCHEMBL7709010 0.88 RAB9A (0.40) RAB9AKMT2AFNTAFNTBAGTR2
SCHEMBL7709015 0.88 RAB9A (0.40) RAB9AKMT2AFNTAFNTBAGTR2
SCHEMBL7703300 0.82 AGTR2 (0.45) FNTAFNTBAGTR2CYP3A4CYP2C19
SCHEMBL7703291 0.82 AGTR2 (0.45) FNTAFNTBAGTR2CYP3A4CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6414145-B1 TREATING CANCER AND NEUROFIBROMATOSIS ZENECA LIMITED (GB) 2002-07-02 US claimed
EP-0975603-A1 INHIBITORS OF FARNESYL PROTEIN TRANSFERASE ZENECA LIMITED (GB) 2000-02-02 EP claimed
WO-1998032741-A1 INHIBITORS OF FARNESYL PROTEIN TRANSFERASE ZENECA LIMITED (GB) 1998-07-30 WO claimed
US-6414145-B1 TREATING CANCER AND NEUROFIBROMATOSIS ZENECA LIMITED (GB) 2002-07-02 US disclosed
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