SCHEMBL16273258

SCHEMBL16273258

CNC(=O)c1cc(C(=O)Nc2ccc(Oc3ccc(C)cc3OC)c(OC)c2)c(C(=O)O)cc1OC=O

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SCN8A Q9UQD0 1/20 0.44
▸ SCN10A Q9Y5Y9 1/20 0.44
▸ STAT3 P40763 1/20 0.43
▸ KMT2A Q03164 4/20 0.43
▸ POLB P06746 3/20 0.41
▸ MEN1 O00255 3/20 0.40
▸ CYP2C9 P11712 2/20 0.40
▸ CYP2C19 P33261 2/20 0.40
▸ NPC1 O15118 2/20 0.40
▸ RAB9A P51151 2/20 0.40
▸ AHR P35869 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ KCNK3 O14649 1/20 0.40
▸ KCNK9 Q9NPC2 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ IDO1 P14902 1/20 0.39

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
SCHEMBL15468831 0.92 SCN8A (0.39) SCN8ASCN10ASTAT3KMT2APOLB
SCHEMBL15468825 0.88 SCN10A (0.43) SCN10ASTAT3KMT2AMEN1ALDH1A1
SCHEMBL12786217 0.86 KMT2A (0.45) KMT2APOLBMEN1CYP2C19NPC1
SCHEMBL12894480 0.86 KMT2A (0.45) KMT2APOLBMEN1CYP2C19NPC1
SCHEMBL12555547 0.83 MAPK1 (0.48) KMT2APOLBMEN1NPC1RAB9A
SCHEMBL18562064 0.81 NR1H4 (0.39) STAT3KMT2APOLBMEN1CYP2C9
SCHEMBL20253301 0.80 CYP1A2 (0.43) KMT2APOLBMEN1NPC1RAB9A
SCHEMBL17298062 0.78 MAPK1 (0.52) KMT2APOLBMEN1NPC1ALDH1A1
SCHEMBL20202766 0.77 LCK (0.38) KMT2APOLBMEN1CYP2C9CYP2C19
SCHEMBL20202765 0.76 ALDH1A1 (0.44) KMT2AMEN1CYP2C9CYP2C19RAB9A

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
US-9160004-B2 Lithium ion secondary battery NEC CORPORATION (JP) 2015-10-13 — — US disclosed
US-20140356711-A1 LITHIUM ION SECONDARY BATTERY NEC CORPORATION (JP) 2014-12-04 — — US disclosed
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