SCHEMBL10011577

SCHEMBL10011577

C#CCCOC(=O)CCC(=O)OCCC#C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 1/20 0.44
ADRA1A P35348 1/20 0.44
MAPT P10636 2/20 0.43
BLM P54132 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
DGKA P23743 1/20 0.37
TSHR P16473 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
GSTP1 P09211 1/20 0.34
HTR2C P28335 1/20 0.33
ALOX5 P09917 1/20 0.33
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL10009581 0.93 MEN1 (0.42) ADRA2AADRA1AMAPTBLMMEN1
SCHEMBL10012891 0.91 MAPT (0.47) ADRA2AADRA1AMAPTBLMMEN1
SCHEMBL10012968 0.91 DGKA (0.43) ADRA2AADRA1AMAPTBLMMEN1
SCHEMBL10011989 0.91 DGKA (0.48) ADRA2AADRA1AMAPTBLMMEN1
SCHEMBL10011861 0.89 CYP1A2 (0.43) ADRA2AADRA1AMAPTMEN1KMT2A
SCHEMBL9567462 0.87 MEN1 (0.39) ADRA2AADRA1AMAPTBLMMEN1
SCHEMBL576951 0.87 DGKA (0.45) ADRA2AADRA1AMAPTBLMMEN1
SCHEMBL10011692 0.87 MAPT (0.52) ADRA2AADRA1AMAPTMEN1KMT2A
SCHEMBL18766961 0.86 MAPT (0.45) ADRA2AADRA1AMAPTBLMMEN1
SCHEMBL10011077 0.85 MEN1 (0.43) ADRA2AADRA1AMAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9130244-B2 Nonaqueous electrolyte solution and electrochemical element using same UBE INDUSTRIES, LTD. (JP) 2015-09-08 US claimed
EP-2908376-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME Ube Industries, Ltd. (JP) 2015-08-19 EP claimed
EP-2479831-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME Ube Industries, Ltd. (JP) 2012-07-25 EP claimed
US-20120171581-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME UBE INDUSTRIES, LTD. (JP) 2012-07-05 US claimed
US-12024580-B2 Resin composition suitable for printing and printing methods Montanuniversität Leoben (AT) 2024-07-02 US disclosed
US-12024580-B2 Resin composition suitable for printing and printing methods Montanuniversität Leoben (AT) 2024-07-02 US disclosed
US-20230331956-A1 SULFIDE-CONTAINING STABILIZER SYSTEM FOR THIOL-ENE AND THIOL-YNE COMPOSITIONS BRUNO BOCK CHEMISCHE FABRIK GMBH & CO. KG (DE) 2023-10-19 US disclosed
US-20210317241-A1 RESIN COMPOSITION SUITABLE FOR PRINTING AND PRINTING METHODS Montanuniversität Leoben (AT) 2021-10-14 US disclosed
WO-2020016343-A2 RESIN COMPOSITION SUITABLE FOR PRINTING AND PRINTING METHODS Montanuniversität Leoben (AT) 2020-01-23 WO disclosed
WO-2017064145-A1 PRINTABLE ESTER BASED RESIN COMPOSITIONS AND PRINTING METHOD UTILIZING THE SAME Montanuniversität Leoben (AT) 2017-04-20 WO disclosed
US-9130244-B2 Nonaqueous electrolyte solution and electrochemical element using same UBE INDUSTRIES, LTD. (JP) 2015-09-08 US disclosed
EP-2908376-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME Ube Industries, Ltd. (JP) 2015-08-19 EP disclosed
EP-2479831-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME Ube Industries, Ltd. (JP) 2012-07-25 EP disclosed
US-20120171581-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME UBE INDUSTRIES, LTD. (JP) 2012-07-05 US disclosed
US-4134812-A BLENDING WITH TETRAKIS-(METHYLENE-(3,5-DI-T-BUTYL)-4-HYDROXY-HYDROCINNAMATE)-METHANE, CROSSLINKING WITH AN ACETYLENIC COMPOUND THE FURUKAWA ELECTRIC CO., LTD. (JP) 1979-01-16 US disclosed
US-4113595-A POLYOLEFIN, ACETYLENIC COMPOUND, SECONDARY AMINE JAPAN ATOMIC ENERGY RESEARCH INSTITUTE (JP) 1978-09-12 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-20120171581-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME SLC8A1, OR10J3, SLC8B1 ADRA2A 3098/4885ADRA1A 2739/4885MAPT 4867/4885

“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.