SCHEMBL10411345

SCHEMBL10411345

CCCCc1ccc(O)c(S)c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.55
HPGD P15428 1/20 0.55
MAPK1 P28482 1/20 0.55
HTT P42858 1/20 0.55
RAB9A P51151 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
IAPP P10997 1/20 0.51
IGF1R P08069 3/20 0.50
ALOX15 P16050 3/20 0.50
KAT8 Q9H7Z6 2/20 0.50
CNR1 P21554 1/20 0.50
CNR2 P34972 1/20 0.50
PPARA Q07869 1/20 0.46
SKP2 Q13309 1/20 0.46
ESR1 P03372 2/20 0.46
ADRA2A P08913 2/20 0.46
ADORA3 P0DMS8 2/20 0.46
TACR2 P21452 2/20 0.46
SLC6A2 P23975 2/20 0.46
SLC6A4 P31645 2/20 0.46

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
SCHEMBL9644574 0.94 KAT8 (0.57) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL9845813 0.93 KAT8 (0.59) IAPPIGF1RALOX15KAT8PPARA
SCHEMBL10945340 0.93 KAT8 (0.59) IAPPIGF1RALOX15KAT8PPARA
Methoxymethane SCHEMBL6847722 0.92 KAT8 (0.55) KAT8PPARAESR1ADRA2AADORA3
SCHEMBL30883022 0.82 SKP2 (0.50) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL3053597 0.82 SKP2 (0.50) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL1052163 0.82 ALOX15 (0.75) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL30115075 0.82 ALOX15 (0.75) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL723543 0.80 CNR1 (0.77) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL11316722 0.79 TRPA1 (0.64) HPGDMAPK1HTTRAB9AIGF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106591547-B A kind of quenching oil compound and its manufacturing method 中国石油化工股份有限公司 2018-07-31 CN disclosed
CN-106590767-B A kind of biodiesel composition and its manufacturing method 中国石油化工股份有限公司 2018-05-18 CN disclosed
CN-105566720-A Polymer composition and application thereof CHINA PETROLEUM & CHEM CORP 2016-05-11 CN disclosed
CN-105315183-A Screen phenol compound and its manufacturing method and use as anti-oxidant CHINA PETROLEUM & CHEMICAL 2016-02-10 CN disclosed
CN-105272892-A Hindered phenol compound, preparation method thereof, and application thereof as antioxidant CHINA PETROLEUM & CHEMICAL 2016-01-27 CN disclosed
CN-105218420-A A kind ofly shield phenolic compound, its manufacture method and the application as oxidation inhibitor thereof CHINA PETROLEUM & CHEMICAL 2016-01-06 CN disclosed
CN-105130859-A Screen phenol compound, manufacturing method and application thereof as antioxidant CHINA PETROLEUM & CHEMICAL 2015-12-09 CN disclosed
US-4904815-A PHENOLS WITH ESTER, ACID OR AMIDE FUNCTIONAL GROUPS, STABILIZERS FOR AQUEOUS OR ORGANIC SYSTEMS CIBA-GEIGY AG (CH) 1990-02-27 US disclosed
EP-0106799-B1 PHENOLS AND THEIR PREPARATION CIBA-GEIGY AG (CH) 1986-03-19 EP disclosed
EP-0106799-A1 Phenols and their preparation CIBA-GEIGY AG (CH) 1984-04-25 EP disclosed