SCHEMBL17973397

SCHEMBL17973397

CC(=N\O)/C(=N\O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.50
MAPT P10636 3/20 0.50
GAA P10253 1/20 0.42
CYP2C19 P33261 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
WDR5 P61964 1/20 0.41
ALDH1A1 P00352 3/20 0.39
HPGD P15428 2/20 0.39
HSD17B10 Q99714 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
CTDSP1 Q9GZU7 1/20 0.38
MMP3 P08254 1/20 0.38
BCL2L1 Q07817 1/20 0.38
PDCD1 Q15116 1/20 0.38
CD274 Q9NZQ7 1/20 0.38
KDM4E B2RXH2 1/20 0.38
USP2 O75604 1/20 0.38

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
SCHEMBL5265637 0.87 GAA (0.54) SMN1; SMN2MAPTGAACYP2C19L3MBTL1
SCHEMBL5265634 0.87 GAA (0.54) SMN1; SMN2MAPTGAACYP2C19L3MBTL1
SCHEMBL11373666 0.78 SMN1; SMN2 (0.59) SMN1; SMN2MAPTL3MBTL1ALDH1A1HPGD
SCHEMBL11488533 0.78 SMN1; SMN2 (0.59) SMN1; SMN2MAPTL3MBTL1ALDH1A1HPGD
SCHEMBL11373661 0.78 SMN1; SMN2 (0.59) SMN1; SMN2MAPTL3MBTL1ALDH1A1HPGD
SCHEMBL3368876 0.77 SMN1; SMN2 (0.56) SMN1; SMN2MAPTCYP2C19L3MBTL1WDR5
SCHEMBL4316450 0.77 SMN1; SMN2 (0.56) SMN1; SMN2MAPTCYP2C19L3MBTL1WDR5
SCHEMBL8167479 0.74 SMN1; SMN2 (0.48) SMN1; SMN2MAPTGAACYP2C19L3MBTL1
SCHEMBL7760450 0.73 GAA (0.48) SMN1; SMN2MAPTGAACYP2C19L3MBTL1
SCHEMBL7760451 0.73 GAA (0.48) SMN1; SMN2MAPTGAACYP2C19L3MBTL1

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-2016122160-A1 NOVEL DIOXIMESTER COMPOUND, AND PHOTOPOLYMERIZATION INITIATOR AND PHOTORESIST COMPOSITION CONTAINING SAME 주식회사 삼양사 2016-08-04 WO disclosed