SCHEMBL198600

SCHEMBL198600

CCS(=O)(=O)c1ccc(Cl)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSIP1 O75475 2/20 0.58
GAA P10253 2/20 0.58
ALDH1A1 P00352 4/20 0.56
CYP3A4 P08684 1/20 0.56
MAPK1 P28482 1/20 0.56
NPC1 O15118 1/20 0.55
CA1 P00915 4/20 0.52
CA2 P00918 4/20 0.52
CA12 O43570 3/20 0.52
CA3 P07451 3/20 0.52
CA4 P22748 3/20 0.52
CA6 P23280 3/20 0.52
CA5A P35218 3/20 0.52
CA7 P43166 3/20 0.52
CA9 Q16790 3/20 0.52
CA13 Q8N1Q1 3/20 0.52
CA14 Q9ULX7 3/20 0.52
CA5B Q9Y2D0 3/20 0.52
KDM4E B2RXH2 2/20 0.50
KMT2A Q03164 2/20 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
SCHEMBL5049079 0.93 PSIP1 (0.52) PSIP1GAAALDH1A1CYP3A4MAPK1
SCHEMBL5133527 0.93 PSIP1 (0.52) PSIP1GAAALDH1A1CYP3A4MAPK1
SCHEMBL10455034 0.87 PSIP1 (0.74) PSIP1GAAALDH1A1CYP3A4CA2
SCHEMBL1368829 0.84 KMT2A (0.51) GAAALDH1A1CYP3A4MAPK1NPC1
SCHEMBL3254088 0.82 ALDH1A1 (0.59) ALDH1A1CYP3A4MAPK1NPC1CA1
SCHEMBL8993420 0.82 PTGS2 (0.71)
SCHEMBL23043593 0.80 PSIP1 (0.58) PSIP1GAAALDH1A1CYP3A4NPC1
SCHEMBL8789025 0.80 ALDH1A1 (0.56) ALDH1A1CYP3A4MAPK1NPC1CA1
SCHEMBL2914219 0.80 ALDH1A1 (0.56) ALDH1A1CYP3A4MAPK1NPC1CA1
SCHEMBL29048488 0.79 ALDH1A1 (0.50) ALDH1A1CYP3A4MAPK1NPC1CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105566182-B A kind of 2 amino 4(Ethylsulfonyl)The synthetic method of phenol 苏州天马精细化学品股份有限公司 2018-02-13 CN claimed
CN-105566182-A Synthetic method of 2-amino-4-(ethylsulfonyl) phenol SUZHOU TIANMA SPECIALTY CHEMICALS CO LTD 2016-05-11 CN claimed
EP-3632892-B1 METHOD FOR PRODUCING 3-ARYLPROPIONAMIDE COMPOUND SUMITOMO CHEMICAL CO (JP) 2024-07-31 EP disclosed
US-20230312455-A1 PREPARATION OF SUBSTITUTED ACRYLATE COMPOUND HUA MEDICINE (SHANGHAI) LTD. (CN) 2023-10-05 US disclosed
US-11773228-B2 Chemically modified anion exchange membrane and method of preparing the same DANKOOK UNIVERSITY CHEONAN CAMPUS INDUSTRY ACADEMIC COOPERATION FOUNDATION 2023-10-03 US disclosed
US-20230163345-A1 LITHIUM FLUORIDE-BASED AND RELATED CATHODE COMPOSITIONS AND BATTERIES COMPRISING THE SAME SILA NANOTECHNOLOGIES, INC. 2023-05-25 US disclosed
CN-110799490-B 3-arylpropionamide compound and method for producing 3-arylpropionate compound 住友化学株式会社 2023-05-02 CN disclosed
US-11552328-B2 Lithium battery cell including cathode having metal fluoride core-shell particle SILA NANOTECHNOLOGIES, INC. (US) 2023-01-10 US disclosed
US-11028056-B2 Method for producing 3-arylpropionamide compound and 3-arylpropionic acid ester compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2021-06-08 US disclosed
US-20200235420-A1 LITHIUM FLUORIDE-BASED AND RELATED CATHODE COMPOSITIONS AND BATTERIES COMPRISING THE SAME SILA NANOTECHNOLOGIES, INC. 2020-07-23 US disclosed
US-20200165209-A1 METHOD FOR PRODUCING 3-ARYLPROPIONAMIDE COMPOUND AND 3-ARYLPROPIONIC ACID ESTER COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2020-05-28 US disclosed
US-20070135477-A1 Benzimidazole derivatives and their use as protein kinases inhibitors ASTEX THERAPEUCTICS, LIMITED (US) 2007-06-14 US disclosed
WO-2006048754-A1 SULFONYL BENZIMIDAZOLE DERIVATIVES PFIZER JAPAN INC. (JP) 2006-05-11 WO disclosed
US-20060094750-A1 Sulfonyl benzimidazole derivatives KON-I KANA 2006-05-04 US disclosed
EP-0258190-B1 PROCESS FOR PREPARING AROMATIC ETHERS AND THIOETHERS CIBA-GEIGY AG (CH) 1991-11-27 EP disclosed
US-4912596-A Dielectric liquids BAYER AKTIENGESELLSCHAFT (DE) 1990-03-27 US disclosed
US-4825005-A Process for the preparation of aromatic ether and thioether compounds CIBA-GEIGY CORPORATION (US) 1989-04-25 US disclosed
EP-0258190-A2 Process for preparing aromatic ethers and thioethers CIBA-GEIGY AG (CH) 1988-03-02 EP disclosed
US-4152510-A AROMATIC DIAMINE CHAIN EXTENDERS BAYER AKTIENGESELLSCHAFT (DE) 1979-05-01 US disclosed
US-4151210-A Process for the production of phenylalkyl sulphones CIBA-GEIGY CORPORATION (US) 1979-04-24 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-20230312455-A1 PREPARATION OF SUBSTITUTED ACRYLATE COMPOUND ACR, ADCYAP1R1, GNPAT PSIP1 2008/4885GAA 373/4885ALDH1A1 76/4885
US-20200165209-A1 METHOD FOR PRODUCING 3-ARYLPROPIONAMIDE COMPOUND AND 3-ARYLPROPIONIC ACID ESTER COMPOUND AADAC, DDT, NAT1 PSIP1 3276/4885GAA 443/4885ALDH1A1 116/4885
US-20070135477-A1 Benzimidazole derivatives and their use as protein kinases inhibitors CDK1, AURKA, CDK2 PSIP1 2473/4885GAA 1133/4885ALDH1A1 1157/4885
US-11028056-B2 Method for producing 3-arylpropionamide compound and 3-arylpropionic acid ester compound AADAC, DDT, NAT1 PSIP1 3276/4885GAA 443/4885ALDH1A1 116/4885
US-20060094750-A1 Sulfonyl benzimidazole derivatives TRPV1, CNR2, CNR1 PSIP1 2702/4885GAA 2823/4885ALDH1A1 2810/4885

“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.