SCHEMBL7370856

SCHEMBL7370856

COc1cc(NC(C)=O)c(Cl)cc1-c1nc(-c2cccnc2)c(C)[nH]1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 3/20 0.47
FOXO1 Q12778 1/20 0.45
LMNA P02545 1/20 0.43
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
HSD17B10 Q99714 1/20 0.41
HPSE Q9Y251 1/20 0.41
MKNK1 Q9BUB5 1/20 0.41
MKNK2 Q9HBH9 1/20 0.41
SMPD3 Q9NY59 1/20 0.41
PDE10A Q9Y233 1/20 0.41
MAPK1 P28482 1/20 0.40
CCNE2 O96020 1/20 0.40
CCNE1 P24864 1/20 0.40
CDK2 P24941 1/20 0.40
ATR Q13535 1/20 0.40
IRAK4 Q9NWZ3 1/20 0.39

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
SCHEMBL7370252 0.84 ALDH1A1 (0.53) NPY5RLMNAALDH1A1HPGDHSD17B10
SCHEMBL7372716 0.83 ALDH1A1 (0.43) LMNAALDH1A1HPGDHSD17B10HPSE
SCHEMBL7368078 0.81 NPY5R (0.53) NPY5RFOXO1MKNK1MKNK2SMPD3
SCHEMBL7372225 0.78 NPY5R (0.62) NPY5RMKNK1MKNK2SMPD3
SCHEMBL7370057 0.78 LMNA (0.43) LMNAMKNK1MKNK2PDE10AMAPK1
SCHEMBL7369602 0.76 NPY5R (0.56) NPY5RMKNK1MKNK2SMPD3PDE10A
SCHEMBL7365692 0.75 NPY5R (0.57) NPY5RALDH1A1HPGDHSD17B10SMPD3
SCHEMBL7370913 0.75 NPY5R (0.57) NPY5RALDH1A1HPGDHSD17B10SMPD3
SCHEMBL7371445 0.74 NPY5R (0.67) NPY5RALDH1A1SMPD3
SCHEMBL7369412 0.74 PDGFRB (0.41) NPY5RLMNAHPSEMKNK1MKNK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4822805-A ANTIINFLAMMATORY AGENTS, CARDIOTONIC AGENTS, ANTIPLATELET AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-04-18 US claimed
EP-0257897-A1 Imidazole compounds, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-03-02 EP claimed
US-4822805-A ANTIINFLAMMATORY AGENTS, CARDIOTONIC AGENTS, ANTIPLATELET AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-04-18 US disclosed
EP-0257897-A1 Imidazole compounds, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-03-02 EP disclosed