SCHEMBL12014331

SCHEMBL12014331

CCC(=O)OCC1CCOC1=O

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
HPGD P15428 2/20 0.38
KDM4E B2RXH2 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CYP1A2 P05177 2/20 0.35
CYP2C19 P33261 2/20 0.35
BLM P54132 1/20 0.35
WRN Q14191 1/20 0.35
HIF1A Q16665 1/20 0.35
CYP2C9 P11712 1/20 0.35
MAPK1 P28482 1/20 0.35
FKBP1A P62942 2/20 0.34

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
SCHEMBL14651383 0.87 NLRP3 (0.46) ALDH1A1HPGDKDM4EHSD17B10
SCHEMBL8763009 0.84 KDM4E (0.36) ALDH1A1HPGDKDM4EHSD17B10CYP1A2
SCHEMBL7657725 0.83 NLRP3 (0.41) ALDH1A1HPGDKDM4EHSD17B10MAPK1
SCHEMBL686004 0.80 SMN1; SMN2 (0.39) ALDH1A1HPGDKDM4EHSD17B10FKBP1A
SCHEMBL111585 0.80 FKBP1A (0.46) ALDH1A1HPGDKDM4EHSD17B10FKBP1A
SCHEMBL14341639 0.79 ALDH1A1 (0.51) ALDH1A1HPGDKDM4EHSD17B10CYP2C19
SCHEMBL12357074 0.78 FKBP1A (0.32) ALDH1A1HPGDKDM4EHSD17B10CYP1A2
SCHEMBL17281564 0.78 POLB (0.36) ALDH1A1HPGDKDM4EHSD17B10
SCHEMBL19413885 0.77 FKBP1A (0.39) ALDH1A1HPGDKDM4EHSD17B10FKBP1A
SCHEMBL30229409 0.77 KDM4E (0.44) ALDH1A1HPGDKDM4EHSD17B10CYP1A2

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-8568956-B2 Resist composition and method for producing resist pattern SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-10-29 US disclosed
US-20120219899-A1 RESIST COMPOSITION AND METHOD FOR PRODUCING RESIST PATTERN SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-08-30 US disclosed