SCHEMBL2992709

SCHEMBL2992709

CCCCCCCCCCCCCCCCCCOC(C(C)O)N(C)C

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 1/20 0.50
DNM1 Q05193 1/20 0.41
USP2 O75604 1/20 0.39
HTT P42858 2/20 0.38
LPAR1 Q92633 4/20 0.36
LPAR3 Q9UBY5 4/20 0.36
LPAR2 Q9HBW0 1/20 0.36
THRB P10828 2/20 0.36
THRA P10827 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL2988608 1.00 SPHK1 (0.50) SPHK1DNM1USP2HTTLPAR1
SCHEMBL2994688 1.00 SPHK1 (0.50) SPHK1DNM1USP2HTTLPAR1
SCHEMBL2981074 1.00 SPHK1 (0.50) SPHK1DNM1USP2HTTLPAR1
SCHEMBL15346771 1.00 SPHK1 (0.50) SPHK1DNM1USP2HTTLPAR1
SCHEMBL1921025 0.86 ALDH1A1 (0.56)
SCHEMBL251629 0.82 SPHK1 (0.43) SPHK1DNM1USP2HTTLPAR1
SCHEMBL5561906 0.82 SPHK1 (0.43) SPHK1DNM1USP2HTTLPAR1
SCHEMBL11129695 0.81 SPHK1 (0.47) SPHK1DNM1USP2HTTTHRB
SCHEMBL2995945 0.79 MEN1 (0.39) SPHK1DNM1USP2HTTLPAR1
SCHEMBL2998974 0.79 MEN1 (0.39) SPHK1DNM1USP2HTTLPAR1

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 17 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
EP-2666459-A1 PROCESS FOR PRODUCING VESICLE COMPOSITION Kao Corporation (JP) 2013-11-27 EP disclosed
US-20130287720-A1 PROCESS FOR PREPARING VESICLE COMPOSITION KAO CORPORATION (JP) 2013-10-31 US disclosed
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-2152652-A1 NOVEL ALKYLOXY-ETHERS AND ALKOXYLATES THEREOF Dow Global Technologies Inc. (US) 2010-02-17 EP 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-2008134387-A1 NOVEL ALKYLOXY-ETHERS AND ALKOXYLATES THEREOF 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 (2 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-20130287720-A1 PROCESS FOR PREPARING VESICLE COMPOSITION CHMP4B, EXOSC9, EXOSC4 SPHK1 1455/4885DNM1 1043/4885USP2 2843/4885
US-20020004605-A1 Method of synthesizing glycidyl ether compounds in the absence of water and organic solvents TET2, DGAT1, ALKBH3 SPHK1 1328/4885DNM1 568/4885USP2 3857/4885

“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.