SCHEMBL7370232

SCHEMBL7370232

COc1ccc(-c2nc(-c3ccccn3)c(C)[nH]2)cc1OC

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 2/20 0.55
SMPD3 Q9NY59 2/20 0.52
KDM4E B2RXH2 5/20 0.48
ALDH1A1 P00352 5/20 0.48
HPGD P15428 5/20 0.48
MAPT P10636 4/20 0.48
LMNA P02545 3/20 0.48
HTT P42858 3/20 0.48
TDP1 Q9NUW8 3/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
POLB P06746 2/20 0.48
PPARG P37231 1/20 0.48
NCOA2 Q15596 1/20 0.48
NCOA1 Q15788 1/20 0.48
GUSB P08236 1/20 0.48
ALOX5 P09917 1/20 0.47
EPHX2 P34913 1/20 0.47
MPO P05164 1/20 0.47

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
SCHEMBL7374031 0.84 MPO (0.47) NPY5RSMPD3KDM4EALDH1A1HPGD
SCHEMBL27662258 0.83 SMPD3 (0.73) NPY5RSMPD3KDM4EALDH1A1HPGD
SCHEMBL7374799 0.79 SMPD3 (0.56) SMPD3KDM4EALDH1A1HPGDMAPT
SCHEMBL7374774 0.78 PDE2A (0.57) NPY5RSMPD3KDM4EALDH1A1HPGD
SCHEMBL29496946 0.78 MEN1 (0.56) KDM4EALDH1A1HPGDMAPTHTT
SCHEMBL5797361 0.78 MEN1 (0.56) KDM4EALDH1A1HPGDMAPTHTT
SCHEMBL7370877 0.77 MEN1 (0.48) KDM4EALDH1A1HPGDMAPTHTT
SCHEMBL31305536 0.74 SMPD3 (0.51) SMPD3KDM4EALDH1A1HPGDMAPT
SCHEMBL27648497 0.74 L3MBTL1 (0.46) KDM4EALDH1A1HPGDMAPTLMNA
SCHEMBL26134931 0.74 SMPD3 (0.51) SMPD3KDM4EALDH1A1HPGDMAPT

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-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