SCHEMBL2991718

SCHEMBL2991718

CCCCCCOCC(O)CN(CCO)CCO

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.64
HTT P42858 2/20 0.57
LPAR5 Q9H1C0 4/20 0.50
ALDH1A1 P00352 2/20 0.49
SPHK1 Q9NYA1 1/20 0.49
MEN1 O00255 1/20 0.47
THRB P10828 1/20 0.47
KMT2A Q03164 1/20 0.47
MAPT P10636 1/20 0.47
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C19 P33261 1/20 0.43
PLA2G2C Q5R387 1/20 0.43
LPAR1 Q92633 6/20 0.40
LPAR3 Q9UBY5 6/20 0.40
LPAR2 Q9HBW0 4/20 0.40
LPAR6 P43657 3/20 0.40
LPAR4 Q99677 3/20 0.40
KDM4E B2RXH2 1/20 0.39
MAPK1 P28482 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
SCHEMBL728005 1.00 USP2 (0.64) USP2HTTLPAR5ALDH1A1SPHK1
SCHEMBL2995939 1.00 USP2 (0.64) USP2HTTLPAR5ALDH1A1SPHK1
SCHEMBL728014 1.00 USP2 (0.64) USP2HTTLPAR5ALDH1A1SPHK1
SCHEMBL2987001 1.00 USP2 (0.64) USP2HTTLPAR5ALDH1A1SPHK1
SCHEMBL26942167 0.97 USP2 (0.60) USP2HTTLPAR5ALDH1A1SPHK1
SCHEMBL757371 0.93 USP2 (0.53) USP2HTTLPAR5ALDH1A1SPHK1
SCHEMBL2384079 0.91 USP2 (0.54) USP2HTTLPAR5ALDH1A1SPHK1
SCHEMBL2384088 0.91 USP2 (0.54) USP2HTTLPAR5ALDH1A1SPHK1
SCHEMBL18296270 0.91 ALDH1A1 (0.55) USP2HTTLPAR5ALDH1A1SPHK1
SCHEMBL27509723 0.90 USP2 (0.62) USP2HTTLPAR5SPHK1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100168450-A1 NOVEL BRANCHED ALKOXYLATES THOEN JOHAN A 2010-07-01 US claimed
EP-2152652-A1 NOVEL ALKYLOXY-ETHERS AND ALKOXYLATES THEREOF Dow Global Technologies Inc. (US) 2010-02-17 EP claimed
EP-2139833-A1 NOVEL BRANCHED ALKOXYLATES Dow Global Technologies Inc. (US) 2010-01-06 EP claimed
WO-2008134390-A1 NOVEL BRANCHED ALKOXYLATES DOW GLOBAL TECHNOLOGIES INC. (US) 2008-11-06 WO claimed
WO-2008134387-A1 NOVEL ALKYLOXY-ETHERS AND ALKOXYLATES THEREOF DOW GLOBAL TECHNOLOGIES INC. (US) 2008-11-06 WO claimed
US-20100179354-A1 NOVEL ALKOXY-ETHERS AND ALKOXYLATES THEREOF THOEN JOHAN A 2010-07-15 US disclosed
US-20100168450-A1 NOVEL BRANCHED ALKOXYLATES THOEN JOHAN A 2010-07-01 US disclosed
EP-2152653-A1 NOVEL ALKOXYLATE-CONTAINING COMPOSITIONS Dow Global Technologies Inc. (US) 2010-02-17 EP disclosed
EP-2139833-A1 NOVEL BRANCHED ALKOXYLATES Dow Global Technologies Inc. (US) 2010-01-06 EP disclosed
WO-2008134390-A1 NOVEL BRANCHED ALKOXYLATES DOW GLOBAL TECHNOLOGIES INC. (US) 2008-11-06 WO disclosed
WO-2008134389-A1 NOVEL ALKOXYLATE-CONTAINING COMPOSITIONS DOW GLOBAL TECHNOLOGIES INC. (US) 2008-11-06 WO disclosed
US-6392064-B2 REACTING AN ALCOHOL WITH EPICHLOROHYDRIN WITH ALKALI METAL HYDROXIDE AND PHASE TRANSFER CATALYST KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2002-05-21 US disclosed
US-20020004605-A1 Method of synthesizing glycidyl ether compounds in the absence of water and organic solvents KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY 2002-01-10 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020004605-A1 Method of synthesizing glycidyl ether compounds in the absence of water and organic solvents TET2, DGAT1, ALKBH3 USP2 3857/4885HTT 1505/4885LPAR5 1629/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.