SCHEMBL2809758

SCHEMBL2809758

COCCOCCOC(=O)c1ccccc1C(=O)OCCOCCOC

nearest known ligand 0.89

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.89
ALDH1A1 P00352 10/20 0.61
TDP1 Q9NUW8 4/20 0.58
L3MBTL1 Q9Y468 3/20 0.58
CYP3A4 P08684 5/20 0.56
MAPK1 P28482 3/20 0.56
TP53 P04637 2/20 0.56
LMNA P02545 2/20 0.54
ABCB11 O95342 1/20 0.48
ADRA2B P18089 1/20 0.48
OPRD1 P41143 1/20 0.48
SCN5A Q14524 1/20 0.48
HSD17B10 Q99714 4/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
NPC1 O15118 3/20 0.46
HPGD P15428 2/20 0.46
RAB9A P51151 2/20 0.46
GLA P06280 1/20 0.46
HIF1A Q16665 1/20 0.46
KDM4E B2RXH2 3/20 0.46

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
SCHEMBL5599951 1.00 TSHR (0.89) TSHRALDH1A1TDP1L3MBTL1CYP3A4
SCHEMBL8900471 0.95 TSHR (0.80) TSHRALDH1A1TDP1L3MBTL1CYP3A4
SCHEMBL29389335 0.94 TSHR (1.00) TSHRALDH1A1TDP1L3MBTL1CYP3A4
SCHEMBL186285 0.94 TSHR (1.00) TSHRALDH1A1TDP1L3MBTL1CYP3A4
SCHEMBL31541130 0.93 TSHR (0.77) TSHRALDH1A1TDP1L3MBTL1CYP3A4
SCHEMBL1286848 0.93 TSHR (0.77) TSHRALDH1A1TDP1L3MBTL1CYP3A4
SCHEMBL27395943 0.89 TSHR (0.71) TSHRALDH1A1TDP1L3MBTL1CYP3A4
SCHEMBL6027113 0.89 TSHR (0.71) TSHRALDH1A1TDP1L3MBTL1CYP3A4
SCHEMBL12377229 0.89 TSHR (0.89) TSHRALDH1A1TDP1L3MBTL1CYP3A4
SCHEMBL11041492 0.89 TSHR (0.70) TSHRALDH1A1TDP1L3MBTL1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050137030-A1 Plasticized polyurethanes for use in golf balls JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2005-06-23 US claimed
US-6849675-B2 Golf ball comprising a plasticized polyurethane ACUSHNET COMPANY (US) 2005-02-01 US claimed
US-20040132899-A1 Golf ball comprising a plasticized polyurethane JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2004-07-08 US claimed
US-5908894-A CROSSLINKING; BLEND CONTAINING CHAIN EXTENDERS, CATALYST; COMMINUTED FORM BASF AKTIENGESELLSCHAFT (DE) 1999-06-01 US claimed
US-9789368-B2 Golf balls comprising a plasticized polyurethane layer ACUSHNET COMPANY (US) 2017-10-17 US disclosed
US-9522305-B2 Golf balls comprising a plasticized polyurethane layer ACUSHNET COMPANY (US) 2016-12-20 US disclosed
US-20160287945-A1 GOLF BALLS COMPRISING A PLASTICIZED POLYURETHANE LAYER ACUSHNET COMPANY (US) 2016-10-06 US disclosed
US-20160287946-A1 GOLF BALLS COMPRISING A PLASTICIZED POLYURETHANE LAYER ACUSHNET COMPANY (US) 2016-10-06 US disclosed
US-20160287947-A1 GOLF BALLS COMPRISING A PLASTICIZED POLYURETHANE LAYER ACUSHNET COMPANY (US) 2016-10-06 US disclosed
EP-1818361-B1 Preparing sterile articles from polymers containing a stabiliser based on a poly(oxyalkylene) OCCIDENTAL CHEM CO (US) 2013-07-24 EP disclosed
EP-1785446-B1 MULTILAYERED PELLET COMPRISING ETHYLENE-VINYL ALCOHOL COPOLYMER RESIN COMPOSITION KURARAY CO (JP) 2013-01-02 EP disclosed
US-20100255934-A1 COMPOSITIONS FOR GOLF EQUIPMENT ACUSHNET COMPANY 2010-10-07 US disclosed
WO-2002017972-A2 PREPARING STERILE ARTICLES FROM POLYMERS CONTAINING A STABILISER BASED ON A POLY(OXYALKYLENE) OCCIDENTAL CHEMICAL CORPORATION (US) 2002-03-07 WO disclosed
US-6348517-B1 HALOGEN CONTAINING POLYMERS WITH STABILIZERS FOR STERILE ARTICLES OXY SERVICES, INC. 2002-02-19 US disclosed
US-20010016613-A1 Resin composition KURARAY, CO., LTD. (JP) 2001-08-23 US disclosed
US-5908894-A CROSSLINKING; BLEND CONTAINING CHAIN EXTENDERS, CATALYST; COMMINUTED FORM BASF AKTIENGESELLSCHAFT (DE) 1999-06-01 US disclosed
EP-0545312-B1 Heat shrinkable film and multilayered film KURARAY CO (JP) 1998-07-15 EP disclosed
EP-0814125-A2 Resin composition KURARAY CO., LTD. (JP) 1997-12-29 EP disclosed
US-5344715-A Heat shrinkable film and multilayered film KURARAY CO., LTD. (JP) 1994-09-06 US disclosed
EP-0545312-A1 Heat shrinkable film and multilayered film KURARAY CO., LTD. (JP) 1993-06-09 EP disclosed