SCHEMBL20837488

SCHEMBL20837488

C1=Nc2ccc(-c3c[nH]c4ccccc34)cc2C1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
IMPDH2 P12268 3/20 0.51
MAPK1 P28482 1/20 0.51
HSD17B10 Q99714 1/20 0.51
TDO2 P48775 12/20 0.51
NR4A2 P43354 1/20 0.48
ALOX5 P09917 1/20 0.46
PDGFRB P09619 1/20 0.44
PDGFRA P16234 1/20 0.44
ASH1L Q9NR48 1/20 0.44
KDR P35968 1/20 0.43

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
SCHEMBL17114123 0.86 TDO2 (0.49) IMPDH2MAPK1HSD17B10TDO2NR4A2
SCHEMBL31070511 0.74 NR4A2 (0.53) IMPDH2MAPK1HSD17B10TDO2NR4A2
SCHEMBL28377762 0.73 NR4A2 (0.81) IMPDH2MAPK1HSD17B10TDO2NR4A2
SCHEMBL17114069 0.72 IMPDH2 (0.55) IMPDH2MAPK1HSD17B10TDO2NR4A2
SCHEMBL17114098 0.72 TDO2 (0.45) IMPDH2MAPK1HSD17B10TDO2NR4A2
SCHEMBL28416622 0.71 NR4A2 (0.78) IMPDH2MAPK1HSD17B10TDO2NR4A2
SCHEMBL25401778 0.69 CD274 (0.52) IMPDH2MAPK1HSD17B10TDO2NR4A2
SCHEMBL29713619 0.69 TDO2 (0.70) IMPDH2MAPK1HSD17B10TDO2NR4A2
SCHEMBL238277 0.69 IMPDH2 (1.00) IMPDH2MAPK1HSD17B10TDO2NR4A2
SCHEMBL29431212 0.69 IMPDH2 (1.00) IMPDH2MAPK1HSD17B10TDO2NR4A2

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
US-20190085146-A1 COMPOSITION FOR FOAM, FOAM, METHOD FOR PRODUCING THEM, AND FOAM MOLDED ARTICLE JXTG NIPPON OIL & ENERGY CORPORATION (JP) 2019-03-21 US disclosed