SCHEMBL544818

SCHEMBL544818

CCCCC(CC)COC(=O)OC

nearest known ligand 0.66

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 6/20 0.66
TSHR P16473 4/20 0.66
TDP1 Q9NUW8 2/20 0.66
ATM Q13315 1/20 0.66
ALDH1A1 P00352 6/20 0.57
CA2 P00918 4/20 0.57
RECQL P46063 1/20 0.54
CA1 P00915 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.52
LMNA P02545 3/20 0.51
MAPK1 P28482 2/20 0.50
HSD17B10 Q99714 1/20 0.50
PRSS1 P07477 1/20 0.50
PRSS2 P07478 1/20 0.50
PRSS3 P35030 1/20 0.50
MMP9 P14780 1/20 0.48
MMP8 P22894 1/20 0.48
MMP14 P50281 1/20 0.48
ZDHHC7 Q9NXF8 1/20 0.46

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
SCHEMBL13875477 1.00 CYP3A4 (0.66) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL94797 0.92 CYP3A4 (0.70) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL30101898 0.90 CYP3A4 (0.68) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL27624666 0.90 CYP3A4 (0.68) CYP3A4TSHRTDP1ATMALDH1A1
Hydrogen Peroxide SCHEMBL28532747 0.90 CYP3A4 (0.68) CYP3A4TSHRTDP1ATMALDH1A1
Ammonia Solution, Strong SCHEMBL9998237 0.90 CYP3A4 (0.68) CYP3A4TSHRTDP1ATMALDH1A1
Water SCHEMBL6315641 0.90 CYP3A4 (0.68) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL5489987 0.89 CYP3A4 (0.66) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL35431 0.89 CYP3A4 (0.66) CYP3A4TSHRTDP1ATMALDH1A1
Bicarbonate SCHEMBL9302535 0.89 CYP3A4 (0.66) CYP3A4TSHRTDP1ATMALDH1A1

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 47 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220209301-A1 CARBONATE SOLVENTS FOR NON-AQUEOUS ELECTROLYTES FOR METAL AND METAL-ION BATTERIES SCE FRANCE (FR) 2022-06-30 US claimed
EP-3956288-A1 CARBONATE SOLVENTS FOR NON-AQUEOUS ELECTROLYTES FOR METAL AND METAL-ION BATTERIES SCE France (FR) 2022-02-23 EP claimed
CN-113795963-A Carbonate solvents for non-aqueous electrolytes for metal and metal ion batteries 斯塞法国公司 2021-12-14 CN claimed
WO-2020212872-A1 CARBONATE SOLVENTS FOR NON-AQUEOUS ELECTROLYTES FOR METAL AND METAL-ION BATTERIES SCE FRANCE (FR) 2020-10-22 WO claimed
US-20100331565-A1 Dialkyl Carbonates of Branched Alcohols and their Use COGNIS IP MANAGEMENT GMBH (DE) 2010-12-30 US claimed
US-20250019339-A1 SOLVENT COMPOUNDS FOR USE AS REPLACEMENTS FOR SLOW EVAPORATING SOLVENTS PROJECT CLEAN INC. (CA) 2025-01-16 US disclosed
US-20230360671-A1 MAGNETIC TAPE, MAGNETIC TAPE CARTRIDGE, AND MAGNETIC TAPE APPARATUS FUJIFILM CORPORATION (JP) 2023-11-09 US disclosed
US-20220209301-A1 CARBONATE SOLVENTS FOR NON-AQUEOUS ELECTROLYTES FOR METAL AND METAL-ION BATTERIES SCE FRANCE (FR) 2022-06-30 US disclosed
EP-3956288-A1 CARBONATE SOLVENTS FOR NON-AQUEOUS ELECTROLYTES FOR METAL AND METAL-ION BATTERIES SCE France (FR) 2022-02-23 EP disclosed
CN-113795963-A Carbonate solvents for non-aqueous electrolytes for metal and metal ion batteries 斯塞法国公司 2021-12-14 CN disclosed
US-20210309602-A1 SOLVENT COMPOUNDS FOR USE AS REPLACEMENTS FOR SLOW EVAPORATING SOLVENTS TBF ENVIRONMENTAL TECH INC (CA) 2021-10-07 US disclosed
US-20210309602-A1 SOLVENT COMPOUNDS FOR USE AS REPLACEMENTS FOR SLOW EVAPORATING SOLVENTS TBF ENVIRONMENTAL TECH INC (CA) 2021-10-07 US disclosed
WO-2009102556-A2 PROCESS FOR CONTINUOUS PRODUCTION OF ORGANIC CARBONATES OR ORGANIC CARBAMATES AND SOLID CATALYSTS THEREFORE CATALYTIC DISTILLATION TECHNOLOGIES (US) 2009-08-20 WO disclosed
US-20090203933-A1 PROCESS FOR CONTINUOUS PRODUCTION OF ORGANIC CARBONATES OR ORGANIC CARBAMATES AND SOLID CATALYSTS THEREFORE CATALYTIC DISTILLATION TECHNOLOGIES (US) 2009-08-13 US disclosed
US-20090142622-A1 MAGNETIC RECORDING MEDIUM FUJIFILM CORPORATION (JP) 2009-06-04 US disclosed
US-20090087689-A1 MAGNETIC RECORDING MEDIUM FUJIFILM CORPORATION (JP) 2009-04-02 US disclosed
US-20090087685-A1 MAGNETIC RECORDING MEDIUM FUJIFILM CORPORATION (JP) 2009-04-02 US disclosed
US-20080241599-A1 CARBONIC ACID ESTER AND MAGNETIC RECORDING MEDIUM FUJIFILM CORPORATION (JP) 2008-10-02 US disclosed
WO-2008088692-A2 SPIROCHROMANON DERIVATIVES MERCK & CO., INC. (US) 2008-07-24 WO disclosed
US-20080161394-A1 Cosmetic composition comprising at least one volatile carbonic acid ester L'OREAL S.A. (FR) 2008-07-03 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 (5 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-20210309602-A1 SOLVENT COMPOUNDS FOR USE AS REPLACEMENTS FOR SLOW EVAPORATING SOLVENTS TRPV3, TRPV2, CYP3A4 CYP3A4 3/4885TSHR 3347/4885TDP1 1437/4885
US-20250019339-A1 SOLVENT COMPOUNDS FOR USE AS REPLACEMENTS FOR SLOW EVAPORATING SOLVENTS CRAT, TRPV2, TRPA1 CYP3A4 91/4885TSHR 4704/4885TDP1 1352/4885
US-20090203933-A1 PROCESS FOR CONTINUOUS PRODUCTION OF ORGANIC CARBONATES OR ORGANIC CARBAMATES AND SOLID CATALYSTS THEREFORE CA14, CA4, ADH1C CYP3A4 13/4885TSHR 2086/4885TDP1 3365/4885
US-20080241599-A1 CARBONIC ACID ESTER AND MAGNETIC RECORDING MEDIUM CA1, CA3, CA2 CYP3A4 987/4885TSHR 3027/4885TDP1 4464/4885
US-20100331565-A1 Dialkyl Carbonates of Branched Alcohols and their Use GALK1, BCKDK, ADH1C CYP3A4 1390/4885TSHR 3331/4885TDP1 2642/4885

“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.