SCHEMBL7167553

SCHEMBL7167553

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

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.43
S1PR1 P21453 9/20 0.41
S1PR2 O95136 6/20 0.41
S1PR3 Q99500 6/20 0.41
S1PR4 O95977 4/20 0.41
PRSS1 P07477 1/20 0.41
PRSS2 P07478 1/20 0.41
PRSS3 P35030 1/20 0.41
CYP3A4 P08684 3/20 0.40
ALDH1A1 P00352 2/20 0.40
CA2 P00918 1/20 0.40
ESR1 P03372 2/20 0.40
ADRA2A P08913 2/20 0.40
ADORA3 P0DMS8 2/20 0.40
TACR2 P21452 2/20 0.40
SLC6A2 P23975 2/20 0.40
SLC6A4 P31645 2/20 0.40
SLC6A3 Q01959 2/20 0.40
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.40

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
SCHEMBL30229492 0.99 HTR2A (0.42) HTR2AS1PR1S1PR2S1PR3S1PR4
SCHEMBL29663716 0.99 HTR2A (0.42) HTR2AS1PR1S1PR2S1PR3S1PR4
SCHEMBL11310263 0.83 TSHR (0.42) PRSS1PRSS2PRSS3CYP3A4ALDH1A1
SCHEMBL330123 0.82 S1PR1 (0.43) HTR2AS1PR1S1PR2S1PR3S1PR4
SCHEMBL29019756 0.82 ALDH1A1 (0.51) PRSS1PRSS2PRSS3CYP3A4ALDH1A1
SCHEMBL30906014 0.81 S1PR1 (0.42) HTR2AS1PR1S1PR2S1PR3S1PR4
SCHEMBL30111783 0.81 S1PR1 (0.42) HTR2AS1PR1S1PR2S1PR3S1PR4
SCHEMBL30250223 0.81 S1PR1 (0.42) HTR2AS1PR1S1PR2S1PR3S1PR4
SCHEMBL30250236 0.81 S1PR1 (0.42) HTR2AS1PR1S1PR2S1PR3S1PR4
SCHEMBL20139174 0.77 PRSS1 (0.45) PRSS1PRSS2PRSS3CYP3A4ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4126983-A1 METAL-BASED CATALYST FOR PRODUCING POLYDIENES Bridgestone Americas Tire Operations, LLC (US) 2023-02-08 EP disclosed
US-11230622-B2 High cis-1,4 block copolymers of polybutadiene and polyisoprene BRIDGESTONE CORPORATION (JP) 2022-01-25 US disclosed
WO-2021202659-A1 METAL-BASED CATALYST FOR PRODUCING POLYDIENES BRIDGESTONE AMERICAS TIRE OPERATIONS, LLC (US) 2021-10-07 WO disclosed
EP-3277732-B1 DIENE RUBBER COMPOSITION CONFIGURED TO BE VULCANIZED AT LOWER TEMPERATURE; AND MANUFACTURING PROCESS OF RUBBER ARTICLE CARIFLEX PTE LTD (SG) 2021-07-14 EP disclosed
EP-3186287-B1 TRANSPARENT, TOUGH AND HEATPROOF RUBBER COMPOSITION COMPRISING NEODYMIUM-CATALYZED ISOPRENE COMPONENT, AND MANUFACTURING PROCESS FOR THE SAME KRATON POLYMERS US LLC (US) 2020-04-01 EP disclosed
EP-3538575-A1 HIGH CIS-1,4 BLOCK COPOLYMERS OF POLYBUTADIENE AND POLYISOPRENE Bridgestone Corporation (JP) 2019-09-18 EP disclosed
EP-3507104-A1 PRODUCTION OF CIS-1,4-POLYDIENES WITH MULTIPLE SILANE FUNCTIONAL GROUPS PREPARED BYIN-SITU Bridgestone Corporation (JP) 2019-07-10 EP disclosed
EP-3491030-A1 PROCESS FOR PRODUCING HIGH CIS-1,4-POLYDIENE WITH LANTHANIDE-BASED CATALYST COMPOSITIONS Bridgestone Corporation (JP) 2019-06-05 EP disclosed
EP-3458488-A1 PROCESS FOR PRODUCING FUNCTIONALIZED POLYMERS Bridgestone Corporation (JP) 2019-03-27 EP disclosed
US-10077323-B2 Polymers functionalized with imine compounds containing a protected thiol group BRIDGESTONE CORPORATION (JP) 2018-09-18 US disclosed
WO-2016160774-A1 DIENE RUBBER COMPOSITION CONFIGURED TO BE VULCANIZED AT LOWER TEMPERATURE; AND MANUFACTURING PROCESS OF RUBBER ARTICLE KRATON POLYMERS U.S. LLC (US) 2016-10-06 WO disclosed
WO-2016160781-A1 DIENE RUBBER COMPOSITION CONFIGURED TO BE VULCANIZED AT LOWER TEMPERATURE; AND MANUFACTURING PROCESS OF RUBBER ARTICLE KRATON POLYMERS U.S. LLC (US) 2016-10-06 WO disclosed
US-20160289400-A1 DIENE RUBBER COMPOSITION CONFIGURED TO BE VULCANIZED AT LOWER TEMPERATURE; AND MANUFACTURING PROCESS OF RUBBER ARTICLE FROM THE SAME KRATON POLYMERS U.S. LLC (US) 2016-10-06 US disclosed
US-20160289354-A1 POLYMERS FUNCTIONALIZED WITH ACTIVATED NITROGEN HETEROCYCLES CONTAINING A PENDANT FUNCTIONAL GROUP BRIDGESTONE CORPORATION (JP) 2016-10-06 US disclosed
WO-2016123319-A1 AGED LANTHANIDE-BASED CATALYST SYSTEMS AND THEIR USE IN THE PREPARATION OF CIS-1,4-POLYDIENES BRIDGESTONE CORPORATION (JP) 2016-08-04 WO disclosed
WO-2016123370-A1 CIS-1,4-POLYDIENES WITH IMPROVED COLD FLOW RESISTANCE BRIDGESTONE CORPORATION (JP) 2016-08-04 WO disclosed
WO-2016123376-A1 END-FUNCTIONALIZED POLYDIENES BRIDGESTONE CORPORATION (JP) 2016-08-04 WO disclosed
WO-2016081300-A1 BULK POLYMERIZATION OF POLYISOPRENE WITH PREFORMED CATALYST BRIDGESTONE CORPORATION (JP) 2016-05-26 WO disclosed
WO-2016032960-A2 TRANSPARENT, TOUGH AND HEATPROOF RUBBER COMPOSITION COMPRISING NEODYMIUM-CATALYZED ISOPRENE COMPONENT, AND MANUFACTURING PROCESS FOR THE SAME KRATON POLYMERS U.S. LLC (US) 2016-03-03 WO disclosed
WO-2003040231-A1 PROCESS FOR PRODUCING BLENDS OF SYNDIOTACTIC 1,2-POLYBUTADIENE AND RUBBERY ELASTOMERS BRIDGESTONE CORPORATION (JP) 2003-05-15 WO disclosed