SCHEMBL2525316

SCHEMBL2525316

CCOc1cccc(OC)c1OCC

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.63
MAPK1 P28482 1/20 0.50
TSHR P16473 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
POLB P06746 1/20 0.47
HTR2A P28223 1/20 0.47
HTR2C P28335 1/20 0.47
HTR2B P41595 1/20 0.47
ALDH1A1 P00352 4/20 0.47
KDM4E B2RXH2 3/20 0.46
GSK3A P49840 1/20 0.46
HPGD P15428 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
HSD17B10 Q99714 1/20 0.46
TUBB1 Q9H4B7 2/20 0.45
KMT2A Q03164 3/20 0.45
MEN1 O00255 2/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2D6 P10635 1/20 0.45
LMNA P02545 2/20 0.44

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
SCHEMBL2518861 0.96 SMN1; SMN2 (0.68) SMN1; SMN2MAPK1TSHRL3MBTL1POLB
SCHEMBL12129060 0.91 SMN1; SMN2 (0.57) SMN1; SMN2MAPK1TSHRL3MBTL1POLB
SCHEMBL2068454 0.91 ALDH1A1 (0.54) SMN1; SMN2TSHRL3MBTL1POLBALDH1A1
SCHEMBL9719660 0.89 SMN1; SMN2 (0.55) SMN1; SMN2MAPK1TSHRL3MBTL1POLB
Methyl Alcohol SCHEMBL28171303 0.86 ALDH1A1 (0.50) SMN1; SMN2TSHRL3MBTL1ALDH1A1KDM4E
SCHEMBL19612335 0.86 ALDH1A1 (0.50) SMN1; SMN2TSHRL3MBTL1ALDH1A1KDM4E
Potassium Ion SCHEMBL28222970 0.86 ALDH1A1 (0.50) SMN1; SMN2TSHRL3MBTL1POLBALDH1A1
SCHEMBL14612800 0.83 SMN1; SMN2 (0.53) SMN1; SMN2MAPK1TSHRL3MBTL1POLB
SCHEMBL1619631 0.82 SMN1; SMN2 (0.52) SMN1; SMN2MAPK1TSHRL3MBTL1POLB
SCHEMBL11558830 0.82 MEN1 (0.52) SMN1; SMN2MAPK1TSHRL3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170336728-A1 ULTRAVIOLET CURABLE LIQUID COMPOSITION, ULTRAVIOLET CURING INKJET INK, ULTRAVIOLET CURING WET ELECTROPHOTOGRAPHIC LIQUID DEVELOPER, ULTRAVIOLET CURING ELECTROSTATIC INKJET INK, AND IMAGE FORMING METHOD USING THEREOF CANON KABUSHIKI KAISHA (JP) 2017-11-23 US disclosed
US-8039552-B2 Process for producing propylene block copolymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-10-18 US disclosed
US-20100004395-A1 PROCESS FOR PRODUCING PROPYLENE BLOCK COPOLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-01-07 US disclosed