SCHEMBL2812415

SCHEMBL2812415

CC(=O)OC12CC3CC(CC(C3)C1C)C2

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.35
EPHX2 P34913 3/20 0.34
NPSR1 Q6W5P4 1/20 0.33
NPC1 O15118 1/20 0.33
EPHX1 P07099 2/20 0.33
HSD17B10 Q99714 1/20 0.33
GLA P06280 1/20 0.33
SCN1A P35498 1/20 0.32
SCN2A Q99250 1/20 0.32
SCN3A Q9NY46 1/20 0.32
ALDH1A1 P00352 2/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
XBP1 P17861 1/20 0.31
CNR2 P34972 1/20 0.30
ALOX15 P16050 1/20 0.30

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
SCHEMBL27659428 0.85 NAAA (0.35) NAAAEPHX2NPSR1EPHX1HSD17B10
SCHEMBL2184378 0.84 HSD17B10 (0.35) NAAAEPHX2NPSR1EPHX1HSD17B10
SCHEMBL251058 0.83 NAAA (0.32) NAAAEPHX2NPSR1ALDH1A1
SCHEMBL5917758 0.82 THRB (0.37) NAAANPSR1HSD17B10GLASCN1A
SCHEMBL7749055 0.82 SCN1A (0.46) NPSR1GLASCN1ASCN2ASCN3A
SCHEMBL5359724 0.81 NAAA (0.33) NAAANPSR1HSD17B10GLA
SCHEMBL27673001 0.81 OPRM1 (0.36) NAAAEPHX2HSD17B10ALDH1A1CNR2
SCHEMBL27823807 0.80 NAAA (0.31) NAAASCN1ASCN2ASCN3A
SCHEMBL8765832 0.80 EPHX1 (0.35) EPHX2EPHX1GLASCN1ASCN2A
SCHEMBL22832087 0.80 NAAA (0.32) NAAAEPHX2NPSR1

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-20100248144-A1 POSITIVE RESIST COMPOSITION, METHOD OF FORMING RESIST PATTERN TOKYO OHKA KOGYO CO., LTD. (JP) 2010-09-30 US disclosed