SCHEMBL10012151

SCHEMBL10012151

CCC(C([O])=O)C(C)Cc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.58
ACE P12821 2/20 0.53
CYP2D6 P10635 1/20 0.48
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
MME P08473 1/20 0.46
CPA1 P15085 1/20 0.46
ACE2 Q9BYF1 1/20 0.46
CYP1A2 P05177 1/20 0.46
SLC1A3 P43003 1/20 0.43
SLC1A2 P43004 1/20 0.43
SLC1A1 P43005 1/20 0.43
ALPI P09923 1/20 0.43
PKM P14618 1/20 0.43
PTGS1 P23219 1/20 0.43
XIAP P98170 1/20 0.43
SLC7A5 Q01650 1/20 0.43
HPGD P15428 1/20 0.42
SLC6A2 P23975 2/20 0.42
TAAR1 Q96RJ0 2/20 0.42

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
SCHEMBL21598301 0.87 ACE (0.62) TRPA1ACECYP2D6NPC1RAB9A
SCHEMBL28767198 0.80 TRPA1 (0.51) TRPA1ACECYP2D6NPC1RAB9A
SCHEMBL13880222 0.77 ACE (0.55) TRPA1ACECYP2D6NPC1RAB9A
SCHEMBL17169777 0.76 ACE (0.71) TRPA1ACENPC1RAB9AMME
SCHEMBL6722161 0.76 CYP1A2 (0.67) TRPA1NPC1RAB9ACPA1CYP1A2
SCHEMBL4986173 0.75 SLC1A3 (0.56) TRPA1ACECYP2D6NPC1RAB9A
SCHEMBL21264079 0.75 ACE (0.65) TRPA1ACECYP2D6MMECYP1A2
Bicarbonate SCHEMBL7573060 0.75 ALPL (0.53) TRPA1NPC1RAB9ACYP1A2ALPI
Bicarbonate SCHEMBL7581612 0.75 ALPL (0.53) TRPA1NPC1RAB9ACYP1A2ALPI
SCHEMBL6725002 0.75 HPGD (0.58) TRPA1NPC1RAB9ACYP1A2ALPI

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2478981-B1 SILVER-(CONJUGATED COMPOUND) COMPLEX SUMITOMO CHEMICAL CO (JP) 2020-12-23 EP disclosed
US-9704612-B2 Composition of silver-conjugated compound composite SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-07-11 US disclosed
US-9412487-B2 Silver-(conjugated compound) composite SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-08-09 US disclosed
US-20140001422-A1 COMPOSITION OF SILVER-CONJUGATED COMPOUND COMPOSITE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-01-02 US disclosed
EP-2478981-A1 SILVER-(CONJUGATED COMPOUND) COMPLEX Sumitomo Chemical Co., Ltd (JP) 2012-07-25 EP disclosed
US-20120168693-A1 SILVER-(CONJUGATED COMPOUND) COMPOSITE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-07-05 US disclosed