SCHEMBL2052733

SCHEMBL2052733

O=C(O)C(CS)Nc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FNTA P49354 2/20 0.44
FNTB P49356 2/20 0.44
CPA3 P15088 1/20 0.44
FOLH1 Q04609 1/20 0.44
MME P08473 5/20 0.44
KDM4E B2RXH2 1/20 0.44
MAPT P10636 1/20 0.44
THRB P10828 1/20 0.44
ALOX15 P16050 1/20 0.44
NFKB1 P19838 1/20 0.44
PTGS2 P35354 1/20 0.44
THPO P40225 1/20 0.44
RECQL P46063 1/20 0.44
BLM P54132 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CA12 O43570 1/20 0.42
CA9 Q16790 1/20 0.42
GAA P10253 1/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL3385428 1.00 FNTA (0.44) FNTAFNTBCPA3FOLH1MME
SCHEMBL3385432 1.00 FNTA (0.44) FNTAFNTBCPA3FOLH1MME
SCHEMBL2052734 1.00 FNTA (0.44) FNTAFNTBCPA3FOLH1MME
Hydrochloric Acid SCHEMBL30361277 0.98 FNTA (0.43) FNTAFNTBCPA3FOLH1MME
Sulfuric Acid SCHEMBL29009443 0.91 MME (0.42) FNTAFNTBCPA3FOLH1MME
SCHEMBL31530762 0.85 GAA (0.43) FOLH1THRBALOX15RECQLCA12
SCHEMBL30826532 0.83 CA2 (0.43) FNTAFNTBMMEKDM4EMAPT
SCHEMBL2322992 0.83 ACE (0.45) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL2418011 0.82 KDM4E (0.40) FNTAFNTBMMEKDM4EMAPT
SCHEMBL7067906 0.82 KMT2A (0.46) THRBCA12CA9GAAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112972395-B Capsule preparation and preparation method and application thereof 湖北舒邦药业有限公司 2022-12-13 CN claimed
WO-2013001167-A1 NON-TOXIC COMPOSITIONS FOR DECREASING THE RISK OF CANCER CAUSED BY ORAL MICROBES BIOHIT OYJ (FI) 2013-01-03 WO claimed
EP-1904515-B1 SIDE-CHAIN EXTENDED LIGATION AMYLIN PHARMACEUTICALS INC (US) 2010-12-08 EP claimed
US-20090192300-A1 Side-Chain Extended Ligation GENEPROT INC. (CH) 2009-07-30 US claimed
EP-1904515-A1 SIDE-CHAIN EXTENDED LIGATION Amylin Pharmaceuticals, Inc. (US) 2008-04-02 EP claimed
WO-2006133962-A1 SIDE-CHAIN EXTENDED LIGATION AMYLIN PHARMACEUTICALS, INC. (US) 2006-12-21 WO claimed
JP-11335351-A None JP disclosed
EP-4467640-A1 MICROORGANISM AND METHOD FOR THE IMPROVED PRODUCTION OF CYSTEINE AND/OR DERIVATIVES THEREOF Metabolic Explorer (FR) 2024-11-27 EP disclosed
US-11643676-B2 In vitro glycosylation of proteins and enzymes Design-Zyme LLC (US) 2023-05-09 US disclosed
CN-112972395-B Capsule preparation and preparation method and application thereof 湖北舒邦药业有限公司 2022-12-13 CN disclosed
US-20190038611-A1 Novel CYP34A-Specific Inhibitors and Methods of Using Same THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2019-02-07 US disclosed
US-20190038611-A1 Novel CYP34A-Specific Inhibitors and Methods of Using Same THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2019-02-07 US disclosed
CN-107690281-A Cystic fibrosis transmembrane transduction modulator modulators 弗特克斯药品有限公司 2018-02-13 CN disclosed
EP-0425212-A2 Cyclic anti-aggregatory peptides SMITHKLINE BEECHAM CORPORATION (US) 1991-05-02 EP disclosed
US-4841049-A FOR CELLULOSIC FIBERS; BRIGHT BLUE COLORS; WET- AND LIGHTFAST CIBA-GEIGY CORPORATION (US) 1989-06-20 US disclosed
US-4652634-A Water-soluble monoazo compounds containing a N-(sulfoalkyl)-aniline coupling component and a fiber-reactive group of the vinylsulfonyl series in the phenyl or benzothiazole diazo component, suitable as fiber-reactive dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1987-03-24 US disclosed
US-4430259-A Water-soluble disazo compounds suitable as fiber-reactive dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1984-02-07 US disclosed
WO-1982003860-A1 DERIVATIVES OF 1,4-THIAZANE-CARBOXYLIC ACID,PREPARATION AND UTILIZATION THEREOF AND COMPOSITIONS CONTAINING SAME GILLET CLAUDE 1982-11-11 WO disclosed
US-4283196-A FIXING BY ACTION OF AN ALKALINE AGENT AMERICAN HOECHST CORPORATION (US) 1981-08-11 US disclosed
US-4271072-A FIBER-REACTIVE, FOR DYEING NATURAL AND SYNTHETIC POLYAMIDES AND CELULOSES AMERICAN HOECHST CORPORATION (US) 1981-06-02 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-20190038611-A1 Novel CYP34A-Specific Inhibitors and Methods of Using Same CYP3A43, CYP3A4, CYP4B1 FNTA 356/4885FNTB 609/4885CPA3 265/4885
US-20090192300-A1 Side-Chain Extended Ligation CTH, BCAT1, LNPEP FNTA 367/4885FNTB 409/4885CPA3 772/4885
US-11643676-B2 In vitro glycosylation of proteins and enzymes ALDH7A1, OGA, DAO FNTA 2070/4885FNTB 1354/4885CPA3 2581/4885

“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.