SCHEMBL9702565

SCHEMBL9702565

CCCCSc1cccc(-c2ccc(C#N)c(=O)[nH]2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.55
ALDH1A1 P00352 5/20 0.55
GAA P10253 3/20 0.55
GLA P06280 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
AR P10275 4/20 0.48
MDM2 Q00987 1/20 0.42
HPGD P15428 2/20 0.41
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
GALR3 O60755 1/20 0.37
XDH P47989 1/20 0.37
MAOA P21397 2/20 0.36
MAOB P27338 2/20 0.36
MAPT P10636 1/20 0.35
THRB P10828 1/20 0.35
KMT2A Q03164 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
PDE3B Q13370 1/20 0.35
PDE3A Q14432 1/20 0.35

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
SCHEMBL9701346 0.81 KDM4E (0.64) KDM4EALDH1A1GAAGLAL3MBTL1
SCHEMBL9701544 0.80 KDM4E (0.70) KDM4EALDH1A1GAAGLAL3MBTL1
SCHEMBL9701560 0.78 KDM4E (0.59) KDM4EALDH1A1GAAGLAL3MBTL1
SCHEMBL9700710 0.76 KDM4E (0.64) KDM4EALDH1A1GAAGLAL3MBTL1
SCHEMBL9700707 0.76 KDM4E (0.71) KDM4EALDH1A1GAAGLAL3MBTL1
SCHEMBL9530230 0.76 MDM2 (0.41) KDM4EALDH1A1GAAGLAL3MBTL1
SCHEMBL9700772 0.74 XDH (0.35) KDM4EALDH1A1GAAHPGDLMNA
SCHEMBL11740127 0.74 KDM4E (0.57) KDM4EALDH1A1GAAGLAL3MBTL1
SCHEMBL11736261 0.73 KDM4E (0.60) KDM4EALDH1A1GAAGLAL3MBTL1
SCHEMBL9526090 0.73 KDM4E (0.74) KDM4EALDH1A1GAAGLAL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1992006085-A1 PHENYLPYRIDINOL DERIVATIVES AS MEDICAMENTS SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1992-04-16 WO disclosed