SCHEMBL6922362

SCHEMBL6922362

Fc1ccc(-c2c[nH]c(-c3ccnc(N4CCC(N5CCCC5)CC4)c3)n2)cc1F

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 15/20 0.44
KCNH2 Q12809 9/20 0.44
RPS6KB1 P23443 1/20 0.39
AKT1 P31749 1/20 0.39
CSNK1E P49674 1/20 0.39
CYP11B1 P15538 1/20 0.36
CYP11B2 P19099 1/20 0.36

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
SCHEMBL6925731 0.99 HRH3 (0.46) HRH3KCNH2RPS6KB1AKT1CSNK1E
SCHEMBL6926147 0.82 HTR1A (0.41) HRH3CSNK1ECYP11B2
SCHEMBL6924877 0.81 PIK3C3 (0.38) KCNH2RPS6KB1AKT1CYP11B1
SCHEMBL6924977 0.80 TLR9 (0.41) HRH3KCNH2
SCHEMBL6924980 0.80 DRD2 (0.42) KCNH2RPS6KB1AKT1
SCHEMBL6927205 0.80 KCNH2 (0.40) KCNH2CYP11B1CYP11B2
SCHEMBL6925150 0.78 WNT1 (0.42) KCNH2
SCHEMBL6921703 0.78 LRRK2 (0.43) KCNH2RPS6KB1AKT1
SCHEMBL6927914 0.77 TRPV3 (0.43) KCNH2RPS6KB1AKT1
SCHEMBL6927844 0.77 HRH3 (0.43) HRH3

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
US-6514966-B2 Neuropeptide Y antagonists such as 2-chloro-5-(4-(3,4-dich loro-phenyl)-1H-imidazol-2-yl)-pyridine PFIZER INC. 2003-02-04 US disclosed
US-6355635-B1 IMIDAZOLEBENZENE, IMIDAZOLEPYRIDINE COMPOUNDS FOR TREATMENT OF OBESITY PFIZER INC. 2002-03-12 US disclosed