Sugi Predict

Sugi Predict / Compounds / SCHEMBL1482992

SCHEMBL1482992

SCHEMBL1482992

C#CCOC(=O)CCCCC(=O)OCC#C

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ GSTP1 P09211 1/20 0.65
▸ L3MBTL1 Q9Y468 1/20 0.53
▸ EPHX2 P34913 1/20 0.49
▸ TSHR P16473 4/20 0.45
▸ ALDH1A1 P00352 1/20 0.42
▸ TAAR1 Q96RJ0 1/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ DGKA P23743 1/20 0.41
▸ MAPT P10636 3/20 0.41
▸ POLB P06746 1/20 0.41
▸ CYP1A2 P05177 2/20 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
▸ PAM P19021 2/20 0.38

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
SCHEMBL11538420 0.98 GSTP1 (0.62) GSTP1L3MBTL1EPHX2TSHRALDH1A1
SCHEMBL11538433 0.98 GSTP1 (0.62) GSTP1L3MBTL1EPHX2TSHRALDH1A1
SCHEMBL10011215 0.98 GSTP1 (0.62) GSTP1L3MBTL1EPHX2TSHRALDH1A1
SCHEMBL10011454 0.95 GSTP1 (0.59) GSTP1L3MBTL1EPHX2TSHRALDH1A1
SCHEMBL10012695 0.91 GSTP1 (0.57) GSTP1L3MBTL1EPHX2TSHRALDH1A1
SCHEMBL1483317 0.91 GSTP1 (0.57) GSTP1L3MBTL1EPHX2TSHRALDH1A1
SCHEMBL4446043 0.90 GSTP1 (0.53) GSTP1L3MBTL1EPHX2TSHRALDH1A1
SCHEMBL3775783 0.89 GSTP1 (0.56) GSTP1L3MBTL1EPHX2TSHRALDH1A1
SCHEMBL10012032 0.89 GSTP1 (0.56) GSTP1L3MBTL1EPHX2TSHRALDH1A1
SCHEMBL10011227 0.89 GSTP1 (0.56) GSTP1L3MBTL1EPHX2TSHRALDH1A1

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 32 patents — showing the first 20. 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
CN-115522274-B Neutron shielding additive, neutron radiation protection material and preparation method thereof 中广核研究院有限公司 2023-10-24 — — CN disclosed
CN-108341951-B Dynamic polymer with hybrid cross-linked structure and application thereof 厦门天策材料科技有限公司 2023-06-20 — — CN disclosed
CN-115522274-A Neutron shielding additive, neutron radiation protection material and preparation method thereof 中广核研究院有限公司 2022-12-27 — — CN disclosed
CN-107408734-B Nonaqueous electrolyte solution and nonaqueous electrolyte secondary battery using same 三菱化学株式会社 2020-08-18 — — CN disclosed
EP-3273520-B1 NONAQUEOUS ELECTROLYTE AND NONAQUEOUS ELECTROLYTE SECONDARY CELL IN WHICH SAME IS USED MITSUBISHI CHEM CORP (JP) 2020-05-06 — — EP disclosed
US-10424813-B2 Non-aqueous electrolyte solution and non-aqueous electrolyte secondary battery using same MITSUBISHI CHEMICAL CORPORATION (JP) 2019-09-24 — — US disclosed
EP-3252861-B1 NON-AQUEOUS ELECTROLYTE SOLUTION, AND NON-AQUEOUS-ELECTROLYTE SECONDARY CELL USING SAME MITSUBISHI CHEM CORP (JP) 2019-06-26 — — EP disclosed
CN-109666093-A A kind of dynamic aggregation object with hybrid cross-linked network structure 翁秋梅 2019-04-23 — — CN disclosed
US-20120171581-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME UBE INDUSTRIES, LTD. (JP) 2012-07-05 — — US disclosed
US-20110077365-A1 PREPARATION OF ORGANOSILICON-CONTAINING TRIAZOLES MCMASTER UNIVERSITY (CA) 2011-03-31 — — US disclosed
US-20110077365-A1 PREPARATION OF ORGANOSILICON-CONTAINING TRIAZOLES MCMASTER UNIVERSITY (CA) 2011-03-31 — — US disclosed
US-20100181527-A1 NITROXIDE CONTAINING ELECTRODE MATERIALS FOR SECONDARY BATTERIES CIBA CORPORATION 2010-07-22 — — US disclosed
EP-2162937-A1 NITROXIDE CONTAINING ELECTRODE MATERIALS FOR SECONDARY BATTERIES BASF SE (DE) 2010-03-17 — — EP disclosed
WO-2008155247-A1 NITROXIDE CONTAINING ELECTRODE MATERIALS FOR SECONDARY BATTERIES BASF SE (CH) 2008-12-24 — — WO 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 (3 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-20110077365-A1 PREPARATION OF ORGANOSILICON-CONTAINING TRIAZOLES ATR, RNF31, RNF5 GSTP1 3001/4885L3MBTL1 2566/4885EPHX2 2756/4885
US-20100181527-A1 NITROXIDE CONTAINING ELECTRODE MATERIALS FOR SECONDARY BATTERIES CAT, NQO1, NUCB2 GSTP1 448/4885L3MBTL1 3631/4885EPHX2 763/4885
US-20120171581-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME SLC8A1, OR10J3, SLC8B1 GSTP1 3928/4885L3MBTL1 3802/4885EPHX2 1224/4885

“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.