SCHEMBL7648937

SCHEMBL7648937

C[C@H](c1ccccc1)n1cncc1Cn1cc(C(=O)N2CCOCC2)c(-c2cccc3ccccc23)c1

nearest known ligand 0.75

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FNTA P49354 14/20 0.75
FNTB P49356 14/20 0.75
PGGT1B P53609 3/20 0.61
CYP3A4 P08684 1/20 0.53
HTR2C P28335 5/20 0.42
GPBAR1 Q8TDU6 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
SCHEMBL6979046 1.00 FNTA (0.75) FNTAFNTBPGGT1BCYP3A4HTR2C
SCHEMBL6974492 0.91 FNTA (0.63) FNTAFNTBPGGT1BCYP3A4HTR2C
SCHEMBL6980402 0.91 FNTA (0.63) FNTAFNTBPGGT1BCYP3A4HTR2C
SCHEMBL6978930 0.86 FNTA (1.00) FNTAFNTBPGGT1BCYP3A4HTR2C
SCHEMBL27500775 0.82 FNTA (0.84) FNTAFNTBPGGT1BCYP3A4HTR2C
SCHEMBL7084114 0.81 FNTA (0.86) FNTAFNTBPGGT1BCYP3A4HTR2C
SCHEMBL27497640 0.81 FNTA (0.73) FNTAFNTBPGGT1BCYP3A4HTR2C
SCHEMBL7084213 0.81 FNTA (0.88) FNTAFNTBPGGT1BCYP3A4HTR2C
SCHEMBL7515573 0.80 FNTA (0.73) FNTAFNTBPGGT1BCYP3A4HTR2C
SCHEMBL7644612 0.80 FNTA (0.62) FNTAFNTBPGGT1BCYP3A4HTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6472526-B1 SHOWS AN INHIBITORY ACTIVITY AGAINST FARNESYL TRANSFERASE OR PHARMACEUTICALLY ACCEPTABLE SALTS OR ISOMERS THEREOF, IN PHARMACEUTICAL COMPOSITION AND INTERMEDIATES LG CHEMICAL LTD. (KR) 2002-10-29 US disclosed