SCHEMBL10164688

SCHEMBL10164688

COCCOCCOCc1c(-c2ccc(C)s2)sc(-c2ccc(C)s2)c1COCCOCCOC

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ICAM1 P05362 3/20 0.32
SELE P16581 3/20 0.32
VCAM1 P19320 1/20 0.31
NPC1 O15118 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
GFER P55789 1/20 0.30
HSD17B10 Q99714 1/20 0.30
CHEK1 O14757 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
SCHEMBL10164687 1.00 ICAM1 (0.32) ICAM1SELEVCAM1NPC1ALDH1A1
SCHEMBL16996802 0.73 CA2 (0.30) MAPT
SCHEMBL21726232 0.73 CHEK1 (0.35) NPC1ALDH1A1MAPTGFERHSD17B10
SCHEMBL2737070 0.73 DPP4 (0.31) ICAM1SELEVCAM1CHEK1
SCHEMBL13410232 0.72 DPP4 (0.39) NPC1ALDH1A1MAPTGFERHSD17B10
SCHEMBL17122175 0.72 RAPGEF4 (0.32) MAPT
SCHEMBL17122165 0.71 L3MBTL1 (0.36) NPC1ALDH1A1MAPT
SCHEMBL16996813 0.70 RAPGEF4 (0.33)
SCHEMBL16996805 0.69 SMN1; SMN2 (0.36) NPC1ALDH1A1MAPTHSD17B10
SCHEMBL17122168 0.69 GABRA1 (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8173348-B2 Method of forming pattern and composition for forming of organic thin-film for use therein JSR CORPORATION (JP) 2012-05-08 US disclosed
US-20100233635-A1 METHOD OF FORMING PATTERN AND COMPOSITION FOR FORMING OF ORGANIC THIN-FILM FOR USE THEREIN JSR CORPORATION (JP) 2010-09-16 US disclosed