SCHEMBL28130461

SCHEMBL28130461

O=C(c1ccc([Zn])cc1)C(F)(F)F

nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CES1 P23141 1/20 0.60
MLYCD O95822 15/20 0.50
TRPV1 Q8NER1 1/20 0.46
ACHE P22303 1/20 0.41

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
SCHEMBL19056956 0.80 CES1 (0.65) CES1MLYCDTRPV1
SCHEMBL1421656 0.78 CES1 (0.70) CES1MLYCD
SCHEMBL2174033 0.78 CES1 (0.62) CES1MLYCDTRPV1
SCHEMBL16823 0.78 CES1 (0.62) CES1MLYCDTRPV1
SCHEMBL1851024 0.76 CES1 (0.60) CES1MLYCDTRPV1
SCHEMBL7054999 0.76 CES1 (0.60) CES1MLYCDTRPV1ACHE
SCHEMBL978677 0.76 CES1 (0.60) CES1MLYCDTRPV1
SCHEMBL1047383 0.76 CA2 (0.67) CES1MLYCD
SCHEMBL8044420 0.76 CES1 (0.60) CES1MLYCDTRPV1ACHE
SCHEMBL7880210 0.76 CES1 (0.60) CES1MLYCDTRPV1ACHE

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
CN-106414388-A Process for the manufacture of terphenyl compounds 索尔维特殊聚合物美国有限责任公司 2017-02-15 CN disclosed