SCHEMBL726899

SCHEMBL726899

C#CCSc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.52
MAPK1 P28482 1/20 0.52
CA12 O43570 1/20 0.52
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
CA4 P22748 1/20 0.52
CA9 Q16790 1/20 0.52
MAPT P10636 4/20 0.50
RAB9A P51151 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
FFAR1 O14842 1/20 0.43
PTGS2 P35354 2/20 0.41
GRM5 P41594 1/20 0.41
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
HSD17B10 Q99714 2/20 0.39
HPGD P15428 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MGLL Q99685 1/20 0.39
KDM1A O60341 1/20 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
SCHEMBL10576061 0.79 GRM5 (0.41) ALDH1A1MAPK1CA12CA1CA2
SCHEMBL11487306 0.76 CA12 (0.48) ALDH1A1CA12CA1CA2CA4
SCHEMBL10959400 0.76 CA12 (0.53) ALDH1A1CA12CA1CA2CA4
SCHEMBL5178079 0.76 CA12 (0.53) ALDH1A1CA12CA1CA2CA4
SCHEMBL13301431 0.76 ANPEP (0.46) CA12CA1CA2CA4CA9
SCHEMBL302722 0.75 ALDH1A1 (0.52) ALDH1A1MAPK1MAPTRAB9AFFAR1
SCHEMBL10403072 0.75 ALDH1A1 (0.52) ALDH1A1MAPK1MAPTRAB9AFFAR1
SCHEMBL11466226 0.75 ALDH1A1 (0.52) ALDH1A1MAPK1MAPTRAB9AFFAR1
SCHEMBL1931888 0.75 ALDH1A1 (0.52) ALDH1A1MAPK1MAPTRAB9AFFAR1
SCHEMBL11478023 0.74 CA12 (0.44) ALDH1A1CA12CA1CA2CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116885175-A Lithium ion battery 中创新航科技集团股份有限公司 2023-10-13 CN claimed
WO-2023027630-A9 A FLOW REACTOR, METHODS OF FABRICATION AND REACTIONS THEREOF NATIONAL UNIVERSITY OF SINGAPORE (SG) 2023-07-27 WO claimed
WO-2023027630-A2 A FLOW REACTOR, METHODS OF FABRICATION AND REACTIONS THEREOF NATIONAL UNIVERSITY OF SINGAPORE (SG) 2023-03-02 WO claimed
US-11539077-B2 Electrolyte additives containing one, two, or more triple-bonded moieties for silicon anode-based li-ion batteries ENEVATE CORPORATION (US) 2022-12-27 US claimed
WO-2022093792-A1 ELECTROLYTE ADDITIVES CONTAINING ONE, TWO, OR MORE TRIPLE-BONDED MOIETIES FOR SILICON ANODE-BASED BATTERIES ENEVATE CORPORATION (US) 2022-05-05 WO claimed
US-20220131195-A1 ELECTROLYTE ADDITIVES CONTAINING ONE, TWO, OR MORE TRIPLE-BONDED MOIETIES FOR SILICON ANODE-BASED LI-ION BATTERIES ENEVATE CORPORATION 2022-04-28 US claimed
CN-110308502-A The method for preparing molding optical articles PPG工业俄亥俄公司 2019-10-08 CN claimed
US-9920160-B2 Method for synthesis of polymer containing multiple epoxy groups ZHEJIANG UNIVERSITY (CN) 2018-03-20 US claimed
US-20170044304-A1 Method for synthesis of polymer containing multiple epoxy groups UNIV ZHEJIANG (CN) 2017-02-16 US claimed
EP-2681595-B1 PROCESS FOR PREPARING MOLDED OPTICAL ARTICLES PPG IND OHIO INC (US) 2015-02-18 EP claimed
US-20070270548-A1 COMPOSITIONS AND ARTICLES PREPARED FROM THIOETHER FUNCTIONAL OLIGOMERIC POLYTHIOLS PPG INDUSTRIES OHIO, INC. (US) 2007-11-22 US claimed
WO-2007131149-A1 THIOETHER FUNCTIONAL OLIGOMERIC POLYTHIOLS AND ARTICLES PREPARED THEREFROM PPG INDUSTRIES OHIO, INC. (US) 2007-11-15 WO claimed
WO-2007131150-A2 THIOETHER FUNCTIONAL OLIGOMERIC POLYTHIOLS AND ARTICLES PREPARED THEREFROM PPG INDUSTRIES OHIO, INC. (US) 2007-11-15 WO claimed
WO-2007131145-A1 COMPOSITIONS AND ARTICLES PREPARED FROM THIOETHER FUNCTIONAL OLIGOMERIC POLYTHIOLS PPG INDUSTRIES OHIO, INC. (US) 2007-11-15 WO claimed
WO-2007131155-A2 : SEALANT AND ELECTRICAL POTTING FORMULATIONS COMPRISING THIOETHER-FUNCTIONAL OLIGOMETRIC POLYTHIOLS PRC-DESOTO INTERNATIONAL, INC. (US) 2007-11-15 WO claimed
CN-101031543-A Process for preparing aromatic thiophenyl ketones CIBA SC HOLDING AG (CH) 2007-09-05 CN claimed
EP-1799638-A1 PROCESS FOR PREPARING AROMATIC THIOPHENYL KETONES CIBA SPECIALTY CHEMICALS HOLDING INC. Patent Departement (CH) 2007-06-27 EP claimed
EP-1353919-B1 NOVEL QUINUCLIDINE DERIVATIVES AND MEDICINAL COMPOSITIONS CONTAINING THE SAME ALMIRALL PRODESFARMA AG (CH) 2006-07-26 EP claimed
WO-2006034966-A1 PROCESS FOR PREPARING AROMATIC THIOPHENYL KETONES CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2006-04-06 WO claimed
EP-0543919-B1 USE OF HETEROCYCLIC AMINO-ALCOHOL COMPOUNDS IN THE MANUFACTURE OF A MEDICAMENT FOR TREATMENT OF CNS DISEASES SEARLE & CO (US) 1996-04-10 EP claimed

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-20220131195-A1 ELECTROLYTE ADDITIVES CONTAINING ONE, TWO, OR MORE TRIPLE-BONDED MOIETIES FOR SILICON ANODE-BASED LI-ION BATTERIES SELENOI, SIK1, SIK2 ALDH1A1 264/4885MAPK1 902/4885CA12 443/4885
US-11539077-B2 Electrolyte additives containing one, two, or more triple-bonded moieties for silicon anode-based li-ion batteries SELENOI, SIK1, SIK2 ALDH1A1 264/4885MAPK1 902/4885CA12 443/4885

“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.