SCHEMBL8224926

SCHEMBL8224926

CSCC[C@@H](CO)NC(=O)c1ccc(C(OCCn2ccnc2)c2ccc(F)cc2)cc1-c1ccc(F)cc1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FNTA P49354 5/20 0.43
FNTB P49356 5/20 0.43
PGGT1B P53609 1/20 0.43
CYP19A1 P11511 2/20 0.37
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
PTGS2 P35354 1/20 0.36
NAMPT P43490 2/20 0.35
POLB P06746 1/20 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
SCHEMBL7569644 0.90 FNTA (0.54) FNTAFNTBPGGT1B
SCHEMBL7563110 0.88 FNTA (0.57) FNTAFNTBPGGT1B
SCHEMBL7561794 0.83 FNTA (0.40) FNTAFNTBPGGT1BCYP19A1CYP3A4
SCHEMBL7562658 0.83 FNTA (0.41) FNTAFNTBPGGT1B
SCHEMBL8211342 0.82 FNTA (0.42) FNTAFNTBPGGT1BCYP3A4CYP2D6
SCHEMBL7564790 0.82 FNTA (0.49) FNTAFNTBPGGT1B
SCHEMBL7571016 0.81 CYP19A1 (0.46) FNTAFNTBPGGT1BCYP19A1PTGS2
SCHEMBL7563915 0.81 FNTA (0.51) FNTAFNTBPGGT1BCYP19A1CYP3A4
SCHEMBL7668399 0.79 FNTA (0.45) FNTAFNTB
SCHEMBL7668406 0.79 FNTA (0.45) FNTAFNTB

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-1054865-A1 FARNESYL TRANSFERASE INHIBITORS AstraZeneca UK Limited (GB) 2000-11-29 EP claimed
WO-1999041235-A1 FARNESYL TRANSFERASE INHIBITORS ASTRAZENECA UK LIMITED (GB) 1999-08-19 WO claimed