SCHEMBL14979082

SCHEMBL14979082

CN/C=C\C(=N)c1cccc(-c2ccc(-c3ccccc3)cc2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 1/20 0.49
PRSS2 P07478 1/20 0.49
PRSS3 P35030 1/20 0.49
HDAC8 Q9BY41 1/20 0.42
KMO O15229 1/20 0.42
ERCC5 P28715 2/20 0.40
FEN1 P39748 2/20 0.40
HPGD P15428 2/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MAPT P10636 2/20 0.38
GPR52 Q9Y2T5 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
POLB P06746 1/20 0.37
CTDSP1 Q9GZU7 1/20 0.37
LMNA P02545 1/20 0.37
GAA P10253 1/20 0.37
WDR5 P61964 1/20 0.37
GRM5 P41594 1/20 0.37

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
SCHEMBL15034687 0.91 PRSS1 (0.41) PRSS1PRSS2PRSS3HDAC8KMO
SCHEMBL14141387 0.83 PKM (0.38) PRSS1PRSS2PRSS3HPGDKDM4E
SCHEMBL14204477 0.79 MAPT (0.42) HPGDKDM4EALDH1A1SMN1; SMN2MAPT
SCHEMBL14654376 0.79 PRSS1 (0.58) PRSS1PRSS2PRSS3HDAC8KMO
SCHEMBL21152339 0.76 PRSS1 (0.58) PRSS1PRSS2PRSS3HDAC8KMO
SCHEMBL21745729 0.75 PRSS1 (0.54) PRSS1PRSS2PRSS3HPGDKDM4E
SCHEMBL21151946 0.75 ALOX5 (0.49) MAPTGPR52DHODH
SCHEMBL20391726 0.74 PRSS1 (0.60) PRSS1PRSS2PRSS3HDAC8KMO
SCHEMBL17196527 0.73 PRSS1 (0.58) PRSS1PRSS2PRSS3HDAC8KMO
SCHEMBL15290753 0.73 HDAC8 (0.41) PRSS1PRSS2PRSS3HDAC8KMO

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-2013073896-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2013-05-23 WO disclosed