SCHEMBL110502

SCHEMBL110502

c1ccc2c(c1)CCC2=C1CCCC1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CES1 P23141 1/20 0.48
SRD5A1 P18405 2/20 0.47
TSHR P16473 1/20 0.46
HPGD P15428 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CYP2A6 P11509 1/20 0.43
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
SIGMAR1 Q99720 5/20 0.43
SETD7 Q8WTS6 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
SCHEMBL8662164 0.93 CES1 (0.46) CES1SRD5A1TSHRHPGDL3MBTL1
SCHEMBL7621701 0.91 TSHR (0.52) CES1SRD5A1TSHRHPGDL3MBTL1
SCHEMBL536818 0.86 TSHR (0.52) CES1SRD5A1TSHRHPGDL3MBTL1
Styrene SCHEMBL37188 0.84 ALDH1A1 (0.45) CES1SRD5A1TSHRHPGDL3MBTL1
SCHEMBL11671185 0.83 CES1 (0.59) CES1SRD5A1TSHRHPGDL3MBTL1
SCHEMBL11671192 0.83 CES1 (0.59) CES1SRD5A1TSHRHPGDL3MBTL1
SCHEMBL8009481 0.83 CES1 (0.59) CES1SRD5A1TSHRHPGDL3MBTL1
SCHEMBL202264 0.80 TSHR (0.44) CES1TSHRHPGDL3MBTL1CYP2A6
Methane SCHEMBL5909544 0.78 SIGMAR1 (0.43) CES1TSHRHPGDL3MBTL1CYP2A6
Lithium SCHEMBL7545662 0.78 SIGMAR1 (0.43) CES1TSHRHPGDL3MBTL1CYP2A6

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 111 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014176119-A1 FLAME RETARDANT THERMOPLASTIC ELASTOMERS POLYONE CORPORATION (US) 2014-10-30 WO claimed
EP-2424940-A2 FLAME RETARDANT THERMOPLASTIC ELASTOMERS PolyOne Corporation (US) 2012-03-07 EP claimed
WO-2010126855-A2 FLAME RETARDANT THERMOPLASTIC ELASTOMERS POLYONE CORPORATION (US) 2010-11-04 WO claimed
EP-1569703-B1 ELASTOMERIC ARTICLES WITH IMPROVED DAMP SLIP KIMBERLY CLARK CO (US) 2008-06-04 EP claimed
JP-2006511637-A 2006-04-06 JP claimed
EP-1483329-A4 POLYMER COMPOSITIONS TEKNOR APEX CO (US) 2005-11-16 EP claimed
EP-1569703-A1 ELASTOMERIC ARTICLES WITH IMPROVED DAMP SLIP Kimberly-Clark Worldwide, Inc. (US) 2005-09-07 EP claimed
EP-1495711-A1 Flexible tube for an endoscope and an endoscope equipped with the flexible tube PENTAX Corporation (JP) 2005-01-12 EP claimed
EP-1493376-A1 A flexible tube for an endoscope and an endoscope equipped with the flexible tube Pentax Corporation (JP) 2005-01-05 EP claimed
EP-1483329-A1 POLYMER COMPOSITIONS TEKNOR APEX COMPANY (US) 2004-12-08 EP claimed
WO-2004054634-A1 ELASTOMERIC ARTICLES WITH IMPROVED DAMP SLIP KIMBERLY-CLARK WORLDWIDE, INC. (US) 2004-07-01 WO claimed
WO-2003066732-A1 POLYMER COMPOSITIONS TEKNOR APEX COMPANY (US) 2003-08-14 WO claimed
EP-1315776-A2 SYNTHETIC RUBBER ELASTOMERS AS REPLACEMENTS FOR NATURAL RUBBER LATEX Edwards Lifesciences Corporation (US) 2003-06-04 EP claimed
EP-1311318-A2 MANIPULATABLE DELIVERY CATHETER FOR OCCLUSIVE DEVICES Counter Clockwise, Inc. (US) 2003-05-21 EP claimed
WO-2002018490-A2 SYNTHETIC RUBBER ELASTOMERS AS REPLACEMENTS FOR NATURAL RUBBER LATEX EDWARDS LIFESCIENCES CORPORATION (US) 2002-03-07 WO claimed
WO-2002015972-A2 MANIPULATABLE DELIVERY CATHETER FOR OCCLUSIVE DEVICES COUNTER CLOCKWISE, INC. (US) 2002-02-28 WO claimed
EP-0273228-A2 Polypropylene composition Chisso Corporation (JP) 1988-07-06 EP claimed
JP-11131025-A None JP disclosed
EP-0212831-A1 Moldable elastomeric copolymer compositions SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-03-04 EP disclosed
WO-1984000174-A1 ERASABLE INK COMPOSITION AND PROCESS FOR FORMING ERASABLE SCRIPT BIC CORP (US) 1984-01-19 WO disclosed