SCHEMBL31065417

SCHEMBL31065417

C=C(C(=O)O)c1ccccc1.CCCCCCCC1CC(=O)NC1=O

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 1/20 0.39
CYSLTR1 Q9Y271 1/20 0.39
CYP19A1 P11511 4/20 0.38
CES2 O00748 1/20 0.38
CES1 P23141 1/20 0.38
ALDH1A1 P00352 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
NAAA Q02083 1/20 0.37
KCNH2 Q12809 1/20 0.37

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
SCHEMBL31065429 0.90 CRBN (0.45) CYSLTR2CYSLTR1KCNH2
Methacrylic Acid SCHEMBL31065427 0.83 ALDH1A1 (0.47) CYP19A1ALDH1A1L3MBTL1
Methacrylic Acid SCHEMBL31065403 0.83 ALDH1A1 (0.47) CYP19A1ALDH1A1L3MBTL1
Methacrylic Acid SCHEMBL31065433 0.82 ALDH1A1 (0.44) CYP19A1ALDH1A1L3MBTL1
SCHEMBL8697031 0.79 ALDH1A1 (0.54) CYP19A1ALDH1A1L3MBTL1
SCHEMBL3372427 0.79 ALDH1A1 (0.54) CYP19A1ALDH1A1L3MBTL1
SCHEMBL734158 0.79 ALDH1A1 (0.54) CYP19A1ALDH1A1L3MBTL1
SCHEMBL5617175 0.79 ALDH1A1 (0.54) CYP19A1ALDH1A1L3MBTL1
SCHEMBL734754 0.79 ALDH1A1 (0.54) CYP19A1ALDH1A1L3MBTL1
SCHEMBL18626078 0.79 ALDH1A1 (0.54) CYP19A1ALDH1A1L3MBTL1

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-118667066-A Polymer, preparation method, binder, positive electrode sheet, secondary battery and electricity utilization device 宁德时代新能源科技股份有限公司 2024-09-20 CN claimed