SCHEMBL27716751

SCHEMBL27716751

O=C(Nc1cc(C=Cc2ccccc2)ccc1C(=O)O)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.58
TRPM8 Q7Z2W7 1/20 0.58
KCNK2 O95069 4/20 0.52
KCNK10 P57789 4/20 0.52
KMT2A Q03164 2/20 0.52
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52
ACLY P53396 1/20 0.52
CYP1A1 P04798 1/20 0.51
MAOB P27338 1/20 0.51
CYP1B1 Q16678 1/20 0.51
MPO P05164 1/20 0.50
PPARG P37231 1/20 0.50
PPARD Q03181 1/20 0.50
PPARA Q07869 1/20 0.50
NR1H4 Q96RI1 1/20 0.50
PTGS1 P23219 1/20 0.50
GRIK1 P39086 2/20 0.49
MEN1 O00255 1/20 0.49
MAPT P10636 1/20 0.49

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
SCHEMBL5145301 0.96 TRPA1 (0.59) TRPA1TRPM8KCNK2KCNK10KMT2A
SCHEMBL5145298 0.96 TRPA1 (0.59) TRPA1TRPM8KCNK2KCNK10KMT2A
SCHEMBL28771390 0.90 LMNA (0.56) TRPA1TRPM8KMT2ANPC1RAB9A
SCHEMBL2276655 0.88 PKM (0.62) KMT2AACLYGRIK1MEN1MAPT
SCHEMBL2276651 0.88 PKM (0.62) KMT2AACLYGRIK1MEN1MAPT
SCHEMBL27716652 0.88 SNCA (0.63) TRPA1KCNK2KCNK10KMT2ANPC1
SCHEMBL2273506 0.87 KCNK2 (0.60) KCNK2KCNK10KMT2AMAOBPPARG
SCHEMBL2273499 0.87 KCNK2 (0.60) KCNK2KCNK10KMT2AMAOBPPARG
SCHEMBL14428444 0.87 NPC1 (0.50) TRPA1TRPM8KMT2ANPC1RAB9A
SCHEMBL28767702 0.85 KCNK2 (0.53) TRPA1TRPM8KCNK2KCNK10KMT2A

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
CN-101094829-B novel anthranilic acid derivative or salt thereof TOYAMA CHEMICAL CO.,LTD. (JP) 2012-02-08 CN disclosed
CN-101094829-A Novel anthranilic acid derivative or salt thereof TOYAMA CHEMICAL CO LTD (JP) 2007-12-26 CN disclosed