SCHEMBL330123

SCHEMBL330123

CCCCCCCCCc1ccc(O[PH](=O)OCC(CC)CCCC)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 5/20 0.43
S1PR4 O95977 3/20 0.42
S1PR2 O95136 3/20 0.42
S1PR5 Q9H228 2/20 0.42
S1PR3 Q99500 2/20 0.42
HTR2A P28223 1/20 0.41
THRB P10828 2/20 0.40
THRA P10827 1/20 0.40
PPARA Q07869 1/20 0.40
PRSS1 P07477 1/20 0.40
PRSS2 P07478 1/20 0.40
PRSS3 P35030 1/20 0.40
ALDH1A1 P00352 3/20 0.39
CYP3A4 P08684 3/20 0.39
CA2 P00918 1/20 0.39
ESR1 P03372 2/20 0.38
ADRA2A P08913 2/20 0.38
ADORA3 P0DMS8 2/20 0.38
TACR2 P21452 2/20 0.38
SLC6A2 P23975 2/20 0.38

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
SCHEMBL30111783 0.99 S1PR1 (0.42) S1PR1S1PR4S1PR2S1PR5S1PR3
SCHEMBL30250223 0.99 S1PR1 (0.42) S1PR1S1PR4S1PR2S1PR5S1PR3
SCHEMBL30906014 0.99 S1PR1 (0.42) S1PR1S1PR4S1PR2S1PR5S1PR3
SCHEMBL30250236 0.99 S1PR1 (0.42) S1PR1S1PR4S1PR2S1PR5S1PR3
SCHEMBL28844342 0.84 ALDH1A1 (0.42) PPARAPRSS1PRSS2PRSS3ALDH1A1
SCHEMBL2767826 0.83 ALDH1A1 (0.49) PPARAPRSS1PRSS2PRSS3ALDH1A1
SCHEMBL7018714 0.82 THRB (0.42) S1PR1S1PR4S1PR2S1PR5S1PR3
SCHEMBL7167553 0.82 HTR2A (0.43) S1PR1S1PR4S1PR2S1PR5S1PR3
SCHEMBL22003951 0.81 ALDH1A1 (0.45) PPARAPRSS1PRSS2PRSS3ALDH1A1
SCHEMBL29663716 0.81 HTR2A (0.42) S1PR1S1PR4S1PR2S1PR5S1PR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110382609-B Studless tire 住友橡胶工业株式会社 2022-03-22 CN disclosed
CN-113056494-A Polybutadiene composition and method for producing same JSR株式会社 2021-06-29 CN disclosed
EP-2671896-B1 COPOLYMER, RUBBER COMPOSITION, CROSSLINKED RUBBER COMPOSITION, AND TIRE BRIDGESTONE CORP (JP) 2021-04-07 EP disclosed
WO-2020235285-A1 MULTI-COMPONENT COPOLYMER, RUBBER COMPOSITION, RESIN COMPOSITION, TIRE, AND RESIN PRODUCT 株式会社ブリヂストン (JP) 2020-11-26 WO disclosed
EP-2599803-B1 COPOLYMER OF CONJUGATED DIENE COMPOUND AND NON-CONJUGATED OLEFIN, RUBBER COMPOSITION, CROSS-LINKED RUBBER COMPOSITION, AND TIRE BRIDGESTONE CORP (JP) 2020-09-02 EP disclosed
EP-3670551-A2 COPOLYMER, RUBBER COMPOSITION, RUBBER COMPOSITION FOR TIRE SIDE USE, CROSSLINKED RUBBER COMPOSITION AND TIRE Bridgestone Corporation (JP) 2020-06-24 EP disclosed
EP-2840095-B1 METHOD FOR PRODUCING POLYMERIZATION CATALYST COMPOSITION, POLYMERIZATION CATALYST COMPOSITION, METHOD FOR PRODUCING POLYMER COMPOSITION, AND POLYMER COMPOSITION BRIDGESTONE CORP (JP) 2020-06-17 EP disclosed
CN-106987038-B Tyre for vehicle wheels 住友橡胶工业株式会社 2020-05-08 CN disclosed
EP-3532514-A2 METHODS TO PREPARE CATALYSTS FOR IN-LINE BULK POLYMERIZATION Bridgestone Corporation (JP) 2019-09-04 EP disclosed
CN-110139882-A High cis-1, 4 block copolymers of polybutadiene and polyisoprene 株式会社普利司通 2019-08-16 CN disclosed
EP-1637548-A1 BUTADIENE POLYMER AND PROCESS FOR PRODUCING THE SAME, AND RUBBER COMPOSITION AND TIRE COMPRISING OR MADE FROM THE SAME Bridgestone Corporation (JP) 2006-03-22 EP disclosed
WO-2003040231-A1 PROCESS FOR PRODUCING BLENDS OF SYNDIOTACTIC 1,2-POLYBUTADIENE AND RUBBERY ELASTOMERS BRIDGESTONE CORPORATION (JP) 2003-05-15 WO disclosed
US-6437205-B1 USING NEODYMIUM CARBOXYLATE, ALUMINOXANE, AND TRIALKYL ALUMINUM CATALYST SYSTEM; GOOD WET TRACTION AND ROLLING RESISTANCE; GOOD PHYSICAL PROPERTIES BRIDGESTONE CORPORATION (JP) 2002-08-20 US disclosed
EP-1189983-A2 LOW MOLECULAR WEIGHT HIGH-CIS POLYBUTADIENES Bridgestone Corporation (JP) 2002-03-27 EP disclosed
CN-1064061-C Novel resin composition ASAHI CHEMICAL IND (JP) 2001-04-04 CN disclosed
WO-2000069928-A2 LOW MOLECULAR WEIGHT HIGH-CIS POLYBUTADIENES BRIDGESTONE CORPORATION (JP) 2000-11-23 WO disclosed
US-5830965-A LIVING ANIONIC POLYMERIZATION ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1998-11-03 US disclosed
US-5795945-A Polymer containing a cyclic olefin monomer unit ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1998-08-18 US disclosed
US-5792824-A Cyclic conjugated diene polymer and method of producing same ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1998-08-11 US disclosed
EP-0743325-A1 NOVEL MODIFIED POLYMER CONTAINING CYCLIC MOLECULAR STRUCTURE UNIT Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1996-11-20 EP disclosed