SCHEMBL13799360

SCHEMBL13799360

CCC(C)(C(=O)OCCCO)C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 3/20 0.39
CYP4A11 Q02928 3/20 0.39
ACHE P22303 6/20 0.33
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL2680750 0.87 ALDH1A1 (0.45) ACHEALDH1A1
SCHEMBL2680747 0.86 NAAA (0.44) ACHEALDH1A1
SCHEMBL2680863 0.84 NAAA (0.47) ACHEALDH1A1
SCHEMBL2680865 0.84 NAAA (0.47) ACHEALDH1A1
SCHEMBL2681600 0.83 HCAR2 (0.34) ALDH1A1
SCHEMBL12198843 0.81 CYP4F2 (0.41) CYP4F2CYP4A11ACHEALDH1A1
SCHEMBL9973346 0.81 ALOX15 (0.32)
SCHEMBL17773370 0.80
SCHEMBL3408327 0.79 CYP4F2 (0.40) CYP4F2CYP4A11ALDH1A1
SCHEMBL17773371 0.79 FFAR3 (0.32) ALDH1A1

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-20090142693-A1 NEGATIVE RESIST COMPOSITION AND METHOD OF FORMING RESIST PATTERN TOKYO OHKA KOGYO CO., LTD. (JP) 2009-06-04 US disclosed