SCHEMBL136443

SCHEMBL136443

CC(C)COC(O)C(C)C

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
TSHR P16473 3/20 0.31
MAPK1 P28482 1/20 0.31

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
Ammonia Solution, Strong SCHEMBL28680415 0.97 ALDH1A1 (0.31) ALDH1A1TSHR
SCHEMBL22811218 0.82 TDP1 (0.43) ALDH1A1TSHRMAPK1
SCHEMBL18254538 0.82 TDP1 (0.43) ALDH1A1TSHRMAPK1
SCHEMBL18254540 0.82 TDP1 (0.43) ALDH1A1TSHRMAPK1
SCHEMBL18254541 0.76 TSHR (0.36) TSHR
SCHEMBL1263276 0.75
SCHEMBL8215205 0.75
SCHEMBL18254370 0.73
SCHEMBL10591436 0.73
SCHEMBL10630868 0.73 TSHR (0.42) ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101381526-B Synthetic technology of phenol-free alkali violet QINGDAO DOUBLE PEACH SPECIALITY CHEMICALS GROUP CO LTD 2011-06-15 CN claimed
CN-101381526-A Synthetic technology of phenol-free alkali violet QINGDAO DOUBLE PEACH SPECIALIT (CN) 2009-03-11 CN claimed
CN-119998260-A Process for preparing amides from esters 巴斯夫欧洲公司 2025-05-13 CN disclosed
US-20230183164-A1 Synthesis of Vinyl Cyclobutyl Intermediates AMGEN INC. (US) 2023-06-15 US disclosed
US-20230174496-A1 Synthesis of Vinylic Protected Alcohol Intermediates AMGEN INC. (US) 2023-06-08 US disclosed
US-20160101054-A1 SUSTAINED DELIVERY OF DRUGS FROM BIODEGRADABLE POLYMERIC MICROPARTICLES YALE UNIVERSITY 2016-04-14 US disclosed
CN-105229156-A For utilizing the method extracting fermentative production butanols BUTAMAX TM ADVANCED BIOFUELS 2016-01-06 CN disclosed
CN-105112962-A Method of preparing nickel gallium alloy by ionic liquid electrodeposition HARBIN INST OF TECHNOLOGY 2015-12-02 CN disclosed
CN-102886114-B Universal easy degraded class A foam extinguishing chemical TIANJIN FIRE FIGHTING INST., MINISTRY OF PUBLIC SECURITY (CN) 2015-08-19 CN disclosed
CN-104822820-A Methods and systems for alcohol production and recovery BUTAMAX TM ADVANCED BIOFUELS 2015-08-05 CN disclosed
EP-2880268-A2 METHOD AND DEVICE FOR GENERATING ELECTRICAL ENERGY Linde Aktiengesellschaft (DE) 2015-06-10 EP disclosed
CN-101381526-B Synthetic technology of phenol-free alkali violet QINGDAO DOUBLE PEACH SPECIALITY CHEMICALS GROUP CO LTD 2011-06-15 CN disclosed
US-7910666-B2 Mercaptan-hardened epoxy polymer compositions and processes for making and using same CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2011-03-22 US disclosed
WO-2010111143-A2 CAL A-RELATED ACYLTRANSFERASES AND METHODS OF USE, THEREOF DANISCO US INC. (US) 2010-09-30 WO disclosed
CN-101381526-A Synthetic technology of phenol-free alkali violet QINGDAO DOUBLE PEACH SPECIALIT (CN) 2009-03-11 CN disclosed
US-20070112100-A1 MERCAPTAN-HARDENED EPOXY POLYMER COMPOSITIONS AND PROCESSES FOR MAKING AND USING SAME CHEVRON PHILLIPS CHEMICAL COMPANY, LP 2007-05-17 US disclosed
EP-1559764-A1 METHOD FOR PRODUCING CERIUM-BASED POLISHING MATERIAL AND CERIUM-BASED POLISHING MATERIAL PRODUCED BY SAID METHOD Mitsui Mining & Smelting Co., Ltd. (JP) 2005-08-03 EP disclosed
US-6901684-B2 Method for producing cerium-based abrasive and cerium-based abrasive produced thereby MITSUI MINING & SMELTING CO., LTD. (JP) 2005-06-07 US disclosed
US-20040182954-A1 Method for producing cerium-based polishing material and cerium-based polishing material produced by said method MITSUI MINING & SMELTING CO., LTD. (JP) 2004-09-23 US disclosed
US-20040166168-A1 Methods for micronization of hydrophobic drugs BROWN UNIVERSITY RESEARCH FOUNDATION 2004-08-26 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-20230174496-A1 Synthesis of Vinylic Protected Alcohol Intermediates MCL1, BCL2A1, BAK1 ALDH1A1 184/4885TSHR 2499/4885MAPK1 171/4885
US-20230183164-A1 Synthesis of Vinyl Cyclobutyl Intermediates MCL1, BCL2A1, BAK1 ALDH1A1 2468/4885TSHR 3142/4885MAPK1 321/4885

“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.