SCHEMBL503435

SCHEMBL503435

COc1ccccc1C(O)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.55
NPSR1 Q6W5P4 2/20 0.53
POLB P06746 2/20 0.53
HTT P42858 2/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
TSHR P16473 2/20 0.50
BLM P54132 1/20 0.50
FABP4 P15090 1/20 0.49
FABP5 Q01469 1/20 0.49
CA1 P00915 3/20 0.48
CA2 P00918 3/20 0.48
CA12 O43570 2/20 0.48
CA7 P43166 2/20 0.48
CA9 Q16790 2/20 0.48
CA14 Q9ULX7 2/20 0.48
LMNA P02545 3/20 0.48
MAPK1 P28482 1/20 0.48
PTGS1 P23219 1/20 0.47
PTGS2 P35354 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL6400516 1.00 KMT2A (0.55) KMT2ANPSR1POLBHTTL3MBTL1
SCHEMBL503436 1.00 KMT2A (0.55) KMT2ANPSR1POLBHTTL3MBTL1
SCHEMBL11081241 0.85 CA12 (0.47) KMT2ANPSR1POLBHTTL3MBTL1
SCHEMBL2461228 0.85 KDM4E (0.50) KMT2ANPSR1POLBHTTL3MBTL1
SCHEMBL2461230 0.85 KDM4E (0.50) KMT2ANPSR1POLBHTTL3MBTL1
SCHEMBL4697541 0.85 FABP4 (0.48) KMT2ANPSR1POLBHTTL3MBTL1
SCHEMBL1354214 0.85 PTGS2 (0.55) TSHRBLMFABP4FABP5LMNA
SCHEMBL14800030 0.85 PTGS2 (0.55) TSHRBLMFABP4FABP5LMNA
SCHEMBL5171115 0.85 PTGS2 (0.55) TSHRBLMFABP4FABP5LMNA
SCHEMBL13170107 0.84 POLB (0.49) KMT2ANPSR1POLBHTTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109467502-B Method for splitting mandelic acid compound enantiomer 湖南科技大学 2021-07-30 CN claimed
EP-1358144-B1 EPOTHILONE SYNTHESIS COMPONENTS I: ASYMMETRICALLY SUBSTITUTED ACYLOINS AND ACYLOIN DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF AND METHOD FOR THE PRODUCTION OF EPITHILONE AND EPOTHILONE DERIVATIVES R & D BIOPHARMACEUTICALS (DE) 2006-12-27 EP claimed
US-6867333-B2 EPOTHILONE SYNTHESIS BUILDING BLOCKS III AND IV: ASYMMETRICALLY SUBSTITUTED ACYLOINS AND ACYLOIN DERIVATIVES, METHODS FOR THEIR PRODUCTION AND METHODS FOR THE PRODUCTION OF EPOTHILONES B, D AND EPOTHILONE DERIVATIVES MORPHOCHEM AG (DE) 2005-03-15 US claimed
US-20040082651-A1 Epothilone synthesis building blocks III and IV: asymmetrically substituted acyloins and acyloin derivatives, methods for their production and methods for the production of epothilones B, D and epothilone derivatives R & D BIOPHARMACEUTICALS GMBH (DE) 2004-04-29 US claimed
EP-1358144-A1 EPOTHILONE SYNTHESIS COMPONENTS III AND IV: ASYMMETRICALLY SUBSTITUTED ACYLOINS AND ACYLOIN DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF AND METHOD FOR THE PRODUCTION OF EPITHILONE B, D AND EPOTHILONE DERIVATIVES Morphochem AG (DE) 2003-11-05 EP claimed
WO-2002032844-A2 EPOTHILONE SYNTHESIS COMPONENTS III AND IV: ASYMMETRICALLY SUBSTITUTED ACYLOINS AND ACYLOIN DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF AND METHOD FOR THE PRODUCTION OF EPITHILONE B, D AND EPOTHILONE DERIVATIVES MORPHOCHEM AG (DE) 2002-04-25 WO claimed
CN-108047033-B Reaction device and method for preparing mandelic acid compound 江西科苑生物药业有限公司 2023-12-01 CN disclosed
EP-4273132-A2 PROCESSES FOR PREPARING ACC INHIBITORS AND SOLID FORMS THEREOF Gilead Sciences, Inc. (US) 2023-11-08 EP disclosed
CN-109467502-B Method for splitting mandelic acid compound enantiomer 湖南科技大学 2021-07-30 CN disclosed
US-20210024537-A1 PROCESSES FOR PREPARING ACC INHIBITORS AND SOLID FORMS THEREOF GILEAD SCIENCES, INC. 2021-01-28 US disclosed
US-10745412-B2 Processes for preparing ACC inhibitors and solid forms thereof GILEAD SCIENCES, INC. (US) 2020-08-18 US disclosed
CN-102603694-B Novel synthesis method of murrayone and novel application of murrayone GANNAN MEDICAL UNIVERSITY 2014-06-25 CN disclosed
CN-101854907-B Cosmetic composition comprising hydroxymethionine and 3-aminopropanesulfonic acid SEDERMA SA 2014-06-18 CN disclosed
US-4126468-A Radiation sensitive compositions of quaternary ammonium salt and carboxylic acid sensitizer VICKERS LIMITED (GB) 1978-11-21 US disclosed
US-4112228-A BACTERICIDES BRISTOL-MYERS COMPANY (US) 1978-09-05 US disclosed
US-4018759-A BACTERICIDES SMITHKLINE CORPORATION (US) 1977-04-19 US disclosed
US-3985738-A ANTIBACTERIAL AGENTS BRISTOL-MYERS COMPANY (US) 1976-10-12 US disclosed
US-3957768-A BACTERICIDES SMITHKLINE CORPORATION (US) 1976-05-18 US disclosed
US-3946005-A BACTERICIDES SMITHKLINE CORPORATION (US) 1976-03-23 US disclosed
US-3943129-A BACTERICIDE SMITHKLINE CORPORATION (US) 1976-03-09 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-20210024537-A1 PROCESSES FOR PREPARING ACC INHIBITORS AND SOLID FORMS THEREOF ACACA, ACACB, ACAT2 KMT2A 2681/4885NPSR1 4672/4885POLB 1076/4885
US-10745412-B2 Processes for preparing ACC inhibitors and solid forms thereof ACACA, ACACB, ACAT2 KMT2A 2681/4885NPSR1 4672/4885POLB 1076/4885
US-20040082651-A1 Epothilone synthesis building blocks III and IV: asymmetrically substituted acyloins and acyloin derivatives, methods for their production and methods for the production of epothilones B, D and epothilone derivatives COASY, ACOX1, FDFT1 KMT2A 1787/4885NPSR1 3404/4885POLB 905/4885

“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.