SCHEMBL12424813

SCHEMBL12424813

O=C1NC(c2ccco2)=C2C(=O)NC(c3ccc(-c4ccccc4)cc3)=C12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP2 O95551 2/20 0.43
SERPINE1 P05121 2/20 0.41
PIK3R1 P27986 1/20 0.40
PIK3CA P42336 1/20 0.40
KDM4E B2RXH2 3/20 0.38
ALDH1A1 P00352 3/20 0.38
HPGD P15428 3/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
HSD17B10 Q99714 1/20 0.38
MYC P01106 1/20 0.38
MEN1 O00255 1/20 0.37
GLA P06280 1/20 0.37
PKM P14618 1/20 0.37
RECQL P46063 1/20 0.37
BLM P54132 1/20 0.37
KMT2A Q03164 1/20 0.37
PTGS2 P35354 4/20 0.37
ELANE P08246 1/20 0.37
NPSR1 Q6W5P4 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
SCHEMBL1277090 0.87 TDP2 (0.41) TDP2SERPINE1KDM4EALDH1A1HPGD
SCHEMBL7754290 0.83 PTGS2 (0.48) TDP2ALDH1A1PTGS2CTRC
SCHEMBL91967 0.83 PTGS2 (0.48) TDP2ALDH1A1PTGS2CTRC
SCHEMBL278635 0.79 GSK3B (0.48) KDM4EALDH1A1HPGDHSD17B10PTGS2
SCHEMBL12577696 0.75 ALDH1A1 (0.56) TDP2ALDH1A1NPC1RAB9APTGS2
SCHEMBL92072 0.75 CYP1A2 (0.56) TDP2KDM4EPTGS2CTRC
SCHEMBL12640639 0.75 PTGS2 (0.42) TDP2ALDH1A1PTGS2CTRC
SCHEMBL12424807 0.74 ADORA2B (0.36) TDP2SERPINE1KDM4EALDH1A1HPGD
SCHEMBL1557806 0.73 GSK3B (0.54) KDM4ENPC1MEN1KMT2APTGS2
SCHEMBL12577691 0.73 ALDH1A1 (0.52) TDP2ALDH1A1NPC1RAB9APTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7977670-B2 Organic transistor TOYO INK MFG. CO., LTD. (JP) 2011-07-12 US disclosed
US-7977670-B2 Organic transistor TOYO INK MFG. CO., LTD. (JP) 2011-07-12 US disclosed
US-20100032657-A1 ORGANIC TRANSISTOR TOYO INK MFG CO., LTD (JP) 2010-02-11 US disclosed
US-20100032657-A1 ORGANIC TRANSISTOR TOYO INK MFG CO., LTD (JP) 2010-02-11 US disclosed