SCHEMBL9526574

SCHEMBL9526574

C/C=C/c1cc(-c2ccc(C#N)c(=O)[nH]2)cc(/C=C/C)c1OC

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.56
ALDH1A1 P00352 5/20 0.56
GAA P10253 4/20 0.56
L3MBTL1 Q9Y468 3/20 0.56
GLA P06280 3/20 0.56
MDM2 Q00987 1/20 0.40
MEN1 O00255 1/20 0.37
USP2 O75604 1/20 0.37
KMT2A Q03164 1/20 0.37
HPGD P15428 2/20 0.35
GALR3 O60755 1/20 0.35
MAPT P10636 1/20 0.34
PIM1 P11309 3/20 0.33
PDE5A O76074 1/20 0.33
LMNA P02545 1/20 0.33
TSHR P16473 1/20 0.33
PTGS1 P23219 1/20 0.33
PDE4A P27815 1/20 0.33
CYP2C19 P33261 1/20 0.33
BLM P54132 1/20 0.33

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
SCHEMBL9526579 1.00 KDM4E (0.56) KDM4EALDH1A1GAAL3MBTL1GLA
SCHEMBL9702642 0.90 ALDH1A1 (0.47) KDM4EALDH1A1GAAL3MBTL1GLA
SCHEMBL9702640 0.90 ALDH1A1 (0.47) KDM4EALDH1A1GAAL3MBTL1GLA
SCHEMBL9525396 0.90 ALDH1A1 (0.49) KDM4EALDH1A1GAAL3MBTL1GLA
SCHEMBL9525387 0.90 ALDH1A1 (0.49) KDM4EALDH1A1GAAL3MBTL1GLA
SCHEMBL7371751 0.85 KDM4E (0.57) KDM4EALDH1A1GAAL3MBTL1GLA
SCHEMBL7371748 0.85 KDM4E (0.57) KDM4EALDH1A1GAAL3MBTL1GLA
SCHEMBL9701832 0.78 KDM4E (0.77) KDM4EALDH1A1GAAL3MBTL1GLA
SCHEMBL9701458 0.76 ALDH1A1 (0.47) KDM4EALDH1A1GAAL3MBTL1GLA
SCHEMBL9701461 0.76 ALDH1A1 (0.47) KDM4EALDH1A1GAAL3MBTL1GLA

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-0550576-A1 PHENYLPYRIDINOL DERIVATIVES AS MEDICAMENTS SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1993-07-14 EP disclosed
WO-1992006085-A1 PHENYLPYRIDINOL DERIVATIVES AS MEDICAMENTS SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1992-04-16 WO disclosed