SCHEMBL16770321

SCHEMBL16770321

CCCCCCCCCCCCCCCCC(F)(F)C(F)(F)OC(F)(F)C(F)(F)S(=O)(=O)O

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CES2 O00748 5/20 0.39
LPAR1 Q92633 1/20 0.39
LPAR3 Q9UBY5 1/20 0.39
EPHX1 P07099 2/20 0.38
CES1 P23141 8/20 0.35
FAAH O00519 7/20 0.35
SMPD1 P17405 1/20 0.33
CA12 O43570 1/20 0.33
CA2 P00918 1/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33
CA14 Q9ULX7 1/20 0.33
MEN1 O00255 1/20 0.33
CYP1A2 P05177 1/20 0.33
KMT2A Q03164 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL12323606 1.00 CES2 (0.39) CES2LPAR1LPAR3EPHX1CES1
SCHEMBL14228102 0.92
SCHEMBL18008764 0.83 CES2 (0.46) CES2LPAR1LPAR3EPHX1CES1
SCHEMBL18007996 0.83 CES2 (0.46) CES2LPAR1LPAR3EPHX1CES1
SCHEMBL18008120 0.83 CES2 (0.46) CES2LPAR1LPAR3EPHX1CES1
SCHEMBL3974059 0.83 CES2 (0.46) CES2LPAR1LPAR3EPHX1CES1
SCHEMBL18008313 0.83 CES2 (0.46) CES2LPAR1LPAR3EPHX1CES1
SCHEMBL16350015 0.81
Ammonia Solution, Strong SCHEMBL18007811 0.81 CES2 (0.44) CES2LPAR1LPAR3EPHX1CES1
Ammonia Solution, Strong SCHEMBL18008893 0.81 CES2 (0.44) CES2LPAR1LPAR3EPHX1CES1

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-9046782-B2 Resist composition for negative tone development and pattern forming method using the same FUJIFILM CORPORATION (JP) 2015-06-02 US disclosed