SCHEMBL6985597

SCHEMBL6985597

COc1ccc(Cn2cncc2-n2cc(-c3cccc4ccccc34)c(C(=O)N3CCN(C)CC3)c2C)cc1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FNTA P49354 9/20 0.48
FNTB P49356 9/20 0.48
PGGT1B P53609 4/20 0.48
CYP3A4 P08684 2/20 0.48
HTR2C P28335 1/20 0.42
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
HPGD P15428 1/20 0.41
KMT2A Q03164 1/20 0.41
CYP11B1 P15538 2/20 0.38
CYP11B2 P19099 2/20 0.38
MAPT P10636 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
LMNA P02545 1/20 0.37

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
SCHEMBL7088695 0.92 FNTA (0.50) FNTAFNTBPGGT1BCYP3A4HTR2C
SCHEMBL6975071 0.91 FNTA (0.49) FNTAFNTBPGGT1BCYP3A4HTR2C
SCHEMBL6982939 0.91 FNTA (0.49) FNTAFNTBPGGT1BCYP3A4HTR2C
SCHEMBL7087365 0.91 FNTA (0.52) FNTAFNTBPGGT1BCYP3A4HTR2C
SCHEMBL7087481 0.88 FNTA (0.49) FNTAFNTBPGGT1BCYP3A4HTR2C
SCHEMBL6982184 0.88 FNTA (0.51) FNTAFNTBPGGT1BCYP3A4HTR2C
SCHEMBL7081052 0.86 FNTA (0.46) FNTAFNTBPGGT1BCYP3A4HTR2C
SCHEMBL6979471 0.84 FNTA (0.46) FNTAFNTBPGGT1BCYP3A4HTR2C
SCHEMBL7084214 0.83 FNTA (0.56) FNTAFNTBPGGT1BCYP3A4HTR2C
SCHEMBL7087345 0.82 FNTA (0.64) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1045846-B1 IMIDAZOLE DERIVATIVES HAVING AN INHIBITORY ACTIVITY FOR FARNESYL TRANSFERASE AND PROCESS FOR PREPARATION THEREOF LG CHEMICAL LTD (KR) 2003-05-02 EP disclosed
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