SCHEMBL17824523

SCHEMBL17824523

CCCCCC(OOC(C)(C)CC)OOC(C)(C)CC

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 3/20 0.37
OPRM1 P35372 1/20 0.33
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
LMNA P02545 1/20 0.31
CA2 P00918 1/20 0.31
DNM1 Q05193 1/20 0.30

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
SCHEMBL28219599 0.86 SMPD1 (0.36) SMPD1OPRM1LMNA
SCHEMBL23292691 0.85 ALDH1A1 (0.36) ALDH1A1TSHRTDP1
SCHEMBL510082 0.83 SMPD1 (0.44) SMPD1OPRM1TSHRTDP1LMNA
SCHEMBL9842540 0.82 SMPD1 (0.39) SMPD1CA2
SCHEMBL31379942 0.81 SMPD1 (0.47) SMPD1OPRM1TSHRLMNACA2
SCHEMBL77792 0.81 SMPD1 (0.47) SMPD1OPRM1TSHRLMNACA2
SCHEMBL7801052 0.80 OPRM1 (0.31) OPRM1ALDH1A1TSHRTDP1
SCHEMBL8213474 0.80 FAAH (0.37) SMPD1OPRM1ALDH1A1LMNACA2
SCHEMBL1230225 0.75 ALDH1A1 (0.39) ALDH1A1TSHRTDP1
SCHEMBL2777803 0.74 GPR84 (0.42) CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108472926-A Peelable composition 汉高知识产权控股有限责任公司 2018-08-31 CN claimed
CN-108026198-A Initiator mixture, composition, its purposes, the polyhydric alcohol polymer for preparing the method for polyhydric alcohol polymer and being obtained by this method 阿肯马法国公司 2018-05-11 CN claimed
CN-104910599-B Plasticizing polylactic acid containing PHA 梅塔玻利克斯公司 2018-02-09 CN claimed
EP-3806689-A1 EVA THERMOPLASTIC COMPOUNDS, METHODS THEREOF, AND ARTICLES THEREFROM Braskem, S.A. (BR) 2021-04-21 EP disclosed
CN-109843937-A It is used to prepare the composition based on allyl monomer and one or more peroxide of organic glass 阿肯马法国公司 2019-06-04 CN disclosed
CN-108472926-A Peelable composition 汉高知识产权控股有限责任公司 2018-08-31 CN disclosed
CN-108026198-A Initiator mixture, composition, its purposes, the polyhydric alcohol polymer for preparing the method for polyhydric alcohol polymer and being obtained by this method 阿肯马法国公司 2018-05-11 CN disclosed
CN-107708853-A Encapsulating 恩盖普有限公司 2018-02-16 CN disclosed
CN-104910599-B Plasticizing polylactic acid containing PHA 梅塔玻利克斯公司 2018-02-09 CN disclosed
EP-3230360-A1 COMPOSITIONS AND METHODS FOR CROSSLINKING POLYMERS IN THE PRESENCE OF ATMOSPHERIC OXYGEN Arkema, Inc. (US) 2017-10-18 EP disclosed
WO-2016094164-A1 COMPOSITIONS AND METHODS FOR CROSSLINKING POLYMERS IN THE PRESENCE OF ATMOSPHERIC OXYGEN ARKEMA INC. (US) 2016-06-16 WO disclosed