SCHEMBL6780405

SCHEMBL6780405

CCCCCCCCCCCCCCCCCCCC(N)(CC)CC

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 4/20 0.46
FDPS P14324 2/20 0.46
TSHR P16473 2/20 0.44
THRB P10828 1/20 0.44
DNM1 Q05193 8/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ALDH1A1 P00352 1/20 0.41
EPHX1 P07099 1/20 0.41
GGPS1 O95749 1/20 0.39

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
SCHEMBL9789212 1.00 SMPD1 (0.46) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL3416673 1.00 SMPD1 (0.46) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL614216 1.00 SMPD1 (0.46) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL770631 1.00 SMPD1 (0.46) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL5450759 1.00 SMPD1 (0.46) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL589417 1.00 SMPD1 (0.46) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL612403 1.00 SMPD1 (0.46) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL1514302 1.00 SMPD1 (0.46) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL3414560 1.00 SMPD1 (0.46) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL3414534 1.00 SMPD1 (0.46) SMPD1FDPSTSHRTHRBDNM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109996857-A Complex ester and monocarboxylic mixture reduce the purposes of friction 巴斯夫欧洲公司 2019-07-09 CN disclosed
CN-109609213-A Purposes of the complex ester in fuel 巴斯夫欧洲公司 2019-04-12 CN disclosed
CN-105765039-B Use of complex esters in fuels 巴斯夫欧洲公司 2019-02-12 CN disclosed
CN-108611134-A Polyalkylene glycol for reducing fuel consumption purposes 巴斯夫欧洲公司 2018-10-02 CN disclosed
CN-105829509-B Purposes of the alkoxylated PolyTHF as fuel additive 巴斯夫欧洲公司 2018-07-13 CN disclosed
CN-105992810-B Use of polyalkylene glycols for reducing fuel consumption 巴斯夫欧洲公司 2018-05-25 CN disclosed
CN-105992810-A Use of polyalkylene glycols for reducing fuel consumption 巴斯夫欧洲公司 2016-10-05 CN disclosed
CN-105829509-A Use of an alkoxylated polytetrahydrofuran as an additive in a fuel 巴斯夫欧洲公司 2016-08-03 CN disclosed
US-6756346-B1 LOW ASH; ENVIRONMENTAL PROTECTION; PHOSPHOROTHIONATE, AMINE SALT OF PHOSPHORUS COMPOUND AND DITHIOPHOSPHATE ANTIWEAR AGENT; POLYALKYLENE POLYAMINE AND CARBOXYLIC ACID RUST PREVENTING AGENT SHELL OIL COMPANY 2004-06-29 US disclosed
EP-1109882-B1 LUBRICATING OIL COMPOSITION USEFUL IN HYDRAULIC FLUIDS SHELL INT RESEARCH (NL) 2002-07-17 EP disclosed
EP-1109882-A1 LUBRICATING OIL COMPOSITION USEFUL IN HYDRAULIC FLUIDS SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 2001-06-27 EP disclosed
WO-2000011122-A1 LUBRICATING OIL COMPOSITION USEFUL IN HYDRAULIC FLUIDS SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) 2000-03-02 WO disclosed