SCHEMBL7080004

SCHEMBL7080004

COCCN(C)C(=O)c1cn(Cc2cncn2Cc2ccc(Br)cc2)nc1-c1cccc2ccccc12

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FNTA P49354 12/20 0.58
FNTB P49356 12/20 0.58
PGGT1B P53609 5/20 0.58
HTR2C P28335 1/20 0.41
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41
CYP3A4 P08684 1/20 0.38
CNR2 P34972 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
SCHEMBL7086800 0.93 FNTA (0.59) FNTAFNTBPGGT1BHTR2CCYP11B1
SCHEMBL7084532 0.91 FNTA (0.56) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL6983519 0.86 FNTA (0.76) FNTAFNTBPGGT1BHTR2CCYP11B1
SCHEMBL6981780 0.82 FNTA (0.62) FNTAFNTBPGGT1BHTR2CCYP11B1
SCHEMBL6981647 0.80 FNTA (0.69) FNTAFNTBPGGT1BHTR2CCYP11B1
SCHEMBL6975814 0.79 FNTA (0.76) FNTAFNTBPGGT1BHTR2CCYP11B1
SCHEMBL6983878 0.79 FNTA (0.76) FNTAFNTBPGGT1BHTR2CCYP11B1
SCHEMBL6980229 0.78 FNTA (0.75) FNTAFNTBPGGT1BHTR2CCYP3A4
SCHEMBL6926980 0.77 FNTA (0.73) FNTAFNTBPGGT1BCYP3A4
SCHEMBL6983323 0.76 FNTA (0.76) FNTAFNTBPGGT1BHTR2CCYP3A4

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 3 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
EP-1045846-A1 IMIDAZOLE DERIVATIVES HAVING AN INHIBITORY ACTIVITY FOR FARNESYL TRANSFERASE AND PROCESS FOR PREPARATION THEREOF LG CHEMICAL LIMITED (KR) 2000-10-25 EP disclosed
WO-1999028315-A1 IMIDAZOLE DERIVATIVES HAVING AN INHIBITORY ACTIVITY FOR FARNESYL TRANSFERASE AND PROCESS FOR PREPARATION THEREOF LG CHEMICAL LTD. (KR) 1999-06-10 WO disclosed