SCHEMBL674608

SCHEMBL674608

CCCCCCCCCc1ccc(OP(=O)(OCC(CC)CCCC)OCC(CC)CCCC)cc1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
S1PR1 P21453 10/20 0.48
S1PR4 O95977 8/20 0.48
S1PR3 Q99500 8/20 0.48
S1PR2 O95136 5/20 0.48
S1PR5 Q9H228 4/20 0.47
ENPP2 Q13822 1/20 0.43
THRA P10827 1/20 0.40
THRB P10828 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

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
SCHEMBL384208 0.88 S1PR1 (0.52) CYP3A4L3MBTL1S1PR1S1PR4S1PR3
SCHEMBL10778815 0.88 S1PR1 (0.52) CYP3A4L3MBTL1S1PR1S1PR4S1PR3
SCHEMBL30250258 0.87 CYP3A4 (0.46) CYP3A4L3MBTL1S1PR1S1PR4S1PR3
SCHEMBL671935 0.87 S1PR1 (0.48) CYP3A4L3MBTL1S1PR1S1PR4S1PR3
SCHEMBL7872461 0.87 CYP3A4 (0.46) CYP3A4L3MBTL1S1PR1S1PR4S1PR3
SCHEMBL640361 0.87 CYP3A4 (0.46) CYP3A4L3MBTL1S1PR1S1PR4S1PR3
SCHEMBL151363 0.87 CYP3A4 (0.46) CYP3A4L3MBTL1S1PR1S1PR4S1PR3
SCHEMBL30250227 0.87 CYP3A4 (0.46) CYP3A4L3MBTL1S1PR1S1PR4S1PR3
SCHEMBL4711373 0.85 CYP3A4 (0.56) CYP3A4L3MBTL1PRSS1PRSS2PRSS3
SCHEMBL31495240 0.84 CYP3A4 (0.62) CYP3A4L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9481746-B2 Modified high-cis isoprene polymer, method for producing the same, and tire containing aforementioned polymer CHI MEI CORPORATION (TW) 2016-11-01 US disclosed
US-9359462-B2 Modified high cis butadiene-isoprene copolymer, method for producing the same and tire having aforementioned polymer CHI MEI CORPORATION (TW) 2016-06-07 US disclosed
US-20150166698-A1 MODIFIED HIGH-CIS ISOPRENE POLYMER, METHOD FOR PRODUCING THE SAME, AND TIRE CONTAINING AFOREMENTIONED POLYMER CHI MEI CORPORATION (TW) 2015-06-18 US disclosed
US-20150166707-A1 MODIFIED HIGH CIS BUTADIENE-ISOPRENE COPOLYMER, METHOD FOR PRODUCING THE SAME AND TIRE HAVING AFOREMENTIONED POLYMER CHI MEI CORPORATION (TW) 2015-06-18 US disclosed
EP-1873168-B1 MODIFIED CONJUGATED DIENE COPOLYMER, RUBBER COMPOSITIONS AND TIRES BRIDGESTONE CORP (JP) 2012-12-12 EP disclosed
US-7968652-B2 Modified conjugated diene copolymer, rubber compositions and tires BRIDGESTONE CORPORATION (JP) 2011-06-28 US disclosed
US-20090292043-A1 MODIFIED CONJUGATED DIENE COPOLYMER, RUBBER COMPOSITIONS AND TIRES BRIDGESTONE CORPORATION (JP) 2009-11-26 US disclosed
EP-1873168-A1 MODIFIED CONJUGATED DIENE COPOLYMER, RUBBER COMPOSITIONS AND TIRES Bridgestone Corporation (JP) 2008-01-02 EP disclosed