SCHEMBL3835519

SCHEMBL3835519

Fc1ccccc1-c1cccc(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPRC P08575 1/20 0.47
PTPN1 P18031 1/20 0.47
PDK2 Q15119 1/20 0.44
TDO2 P48775 1/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
TP53 P04637 1/20 0.43
TSHR P16473 1/20 0.43
NFKB1 P19838 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MAOB P27338 2/20 0.42
ADORA2A P29274 1/20 0.42
ADORA1 P30542 1/20 0.42
MEN1 O00255 1/20 0.42
GAA P10253 1/20 0.42
KMT2A Q03164 1/20 0.42
ALOX5 P09917 1/20 0.42
ACMSD Q8TDX5 1/20 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
SCHEMBL12856837 0.84 PTPRC (0.55) PTPRCPTPN1PDK2NPC1RAB9A
SCHEMBL29628986 0.84 PTPRC (0.55) PTPRCPTPN1PDK2NPC1RAB9A
SCHEMBL9862849 0.84 NPC1 (0.50) PDK2TDO2NPC1RAB9ATP53
SCHEMBL12856709 0.82 PTPRC (0.53) PTPRCPTPN1PDK2NPC1RAB9A
SCHEMBL14685847 0.82 GABRP (0.45) TDO2MAOBMEN1KMT2AALOX5
SCHEMBL5050877 0.80 CYP2A6 (0.52) TDO2NPC1RAB9ATP53TSHR
SCHEMBL5123382 0.80 CNR1 (0.55) TDO2MAOBMEN1KMT2AALOX5
SCHEMBL20898128 0.79 PTGS2 (0.58) PTPRCPTPN1PDK2ADORA2AADORA1
SCHEMBL31067152 0.79 PTGS2 (0.58) PTPRCPTPN1PDK2ADORA2AADORA1
SCHEMBL24315367 0.79 TDO2 (0.40) TDO2NPC1RAB9ATP53TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3619196-B1 2-{[2-(PHENYLOXYMETHYL)PYRIDIN-5-YL]OXY}-ETHANAMIN-DERIVATIVES AND RELATED COMPOUNDS AS PESTICIDES E.G. FOR CROP PROTECTION BAYER CROPSCIENCE AG (DE) 2022-03-30 EP disclosed
EP-2930762-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, ILLUMINATION DEVICE, AND DISPLAY DEVICE Konica Minolta, Inc. (JP) 2015-10-14 EP disclosed
US-8372873-B2 Inhibitors of serine proteases VERTEX PHARMACEUTICALS INCORPORATED (US) 2013-02-12 US disclosed
EP-0946508-B1 NITROGEN CONTAINING HETEROAROMATICS AS FACTOR Xa INHIBITORS BRISTOL MYERS SQUIBB PHARMA CO (US) 2009-09-23 EP disclosed
US-6548512-B1 Pyrazole derivatives such as 1-(3-amidinophenyl)-3-methyl-2-((5-(2'-aminosulfonylphenyl-1-yl)pyrimidin-2 -yl)aminocarbonyl)pyrazole; treating thromboembolic disorders BRISTOL-MYERS SQUIBB PHARMA COMPANY 2003-04-15 US disclosed