SCHEMBL3626784

SCHEMBL3626784

C=Cc1ccc(C)cc1CCCC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 1/20 0.40
TYR P14679 1/20 0.37
MAPT P10636 2/20 0.36
HTT P42858 1/20 0.36
PDE5A O76074 2/20 0.36
ALDH1A1 P00352 2/20 0.36
THRB P10828 2/20 0.36
GAA P10253 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
TAAR1 Q96RJ0 1/20 0.35
TLR8 Q9NR97 2/20 0.35
TP53 P04637 2/20 0.34
NPC1 O15118 1/20 0.34
POLB P06746 1/20 0.34
NFKB1 P19838 1/20 0.34
MAPK1 P28482 1/20 0.34
RAB9A P51151 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL3629044 0.89 TAAR1 (0.37) TLR7MAPTPDE5AALDH1A1THRB
SCHEMBL809697 0.84 MAPT (0.39) MAPTALDH1A1THRBGAANPSR1
SCHEMBL809923 0.84 TAAR1 (0.34) MAPTTAAR1TP53POLBKMT2A
SCHEMBL8373960 0.83 ADORA3 (0.37) TLR7MAPTPDE5ATHRBTLR8
SCHEMBL31056287 0.82 SRC (0.47) TLR7TYRMAPTHTTPDE5A
SCHEMBL12802098 0.82 THRA (0.44) HTTTHRBNPSR1TLR8NPC1
SCHEMBL10426037 0.82 TYR (0.37) TYRMAPTHTTALDH1A1THRB
SCHEMBL25989384 0.81 L3MBTL4 (0.38) ALDH1A1TAAR1TP53KMT2ASRC
SCHEMBL3025738 0.81 TP53 (0.38) MAPTPDE5AALDH1A1TAAR1TP53
SCHEMBL3679575 0.81 TYR (0.36) TYRHTTALDH1A1THRBGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1395449-A4 TIRE AND SUPPORT MICHELIN SOC TECH (FR) 2004-08-11 EP claimed
US-20040112491-A1 Rubber support that conforms to wheel MICHELIN RECHERCHE ET TECHNIQUE S.A. (CH) 2004-06-17 US claimed
EP-1395449-A1 TIRE AND SUPPORT Société de Technologie Michelin (FR) 2004-03-10 EP claimed
WO-2002096680-A1 TIRE AND SUPPORT SOCIETE DE TECHNOLOGIE MICHELIN (FR) 2002-12-05 WO claimed
WO-2002096679-A2 TIRE AND SUPPORT SOCIETE DE TECHNOLOGIE MICHELIN (FR) 2002-12-05 WO claimed
EP-2506357-B1 Separation membrane for direct liquid fuel cell and method for producing same TOKUYAMA CORP (JP) 2015-06-17 EP disclosed
EP-2506357-A1 Separation membrane for direct liquid fuel cell and method for producing same Tokuyama Corporation (JP) 2012-10-03 EP disclosed
US-8232325-B2 Separation membrane for direct liquid fuel cell and method for producing same TOKUYAMA CORPORATION (JP) 2012-07-31 US disclosed
US-20100003574-A1 Separation Membrane for Direct Liquid Fuel Cell and Method for Producing Same TOKUYAMA CORPORATION (JP) 2010-01-07 US disclosed
CN-101516937-A Poly(arylene ether) composition, method and article SABIC INNOVATIVE PLASTICS IP (NL) 2009-08-26 CN disclosed
EP-1990854-A1 SEPARATION MEMBRANE FOR DIRECT LIQUID FUEL CELL AND METHOD FOR PRODUCING SAME Tokuyama Corporation (JP) 2008-11-12 EP disclosed
EP-1395449-A4 TIRE AND SUPPORT MICHELIN SOC TECH (FR) 2004-08-11 EP disclosed
US-20040112491-A1 Rubber support that conforms to wheel MICHELIN RECHERCHE ET TECHNIQUE S.A. (CH) 2004-06-17 US disclosed
EP-1395449-A1 TIRE AND SUPPORT Société de Technologie Michelin (FR) 2004-03-10 EP disclosed
WO-2002096680-A1 TIRE AND SUPPORT SOCIETE DE TECHNOLOGIE MICHELIN (FR) 2002-12-05 WO disclosed
WO-2002096679-A2 TIRE AND SUPPORT SOCIETE DE TECHNOLOGIE MICHELIN (FR) 2002-12-05 WO disclosed