SCHEMBL686784

SCHEMBL686784

CS(=O)(=O)c1ccc2nc(N)sc2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.76
HPGD P15428 3/20 0.76
LMNA P02545 2/20 0.76
HSD17B10 Q99714 2/20 0.76
KMT2A Q03164 2/20 0.76
KDM4E B2RXH2 1/20 0.76
PKM P14618 1/20 0.76
PIK3CD O00329 2/20 0.64
PIK3CB P42338 2/20 0.64
PI4KA P42356 2/20 0.64
PIK3CG P48736 2/20 0.64
PI4KB Q9UBF8 2/20 0.64
PIK3CA P42336 1/20 0.64
MAPT P10636 3/20 0.59
GFER P55789 2/20 0.59
VDR P11473 1/20 0.59
GPR55 Q9Y2T6 1/20 0.59
CYP2D6 P10635 1/20 0.59
PIP5K1C O60331 1/20 0.58
ILK Q13418 1/20 0.58

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
SCHEMBL3024620 0.87 ALDH1A1 (0.57) ALDH1A1HPGDLMNAHSD17B10KMT2A
SCHEMBL8298594 0.86 ALDH1A1 (1.00) ALDH1A1HPGDLMNAHSD17B10KMT2A
SCHEMBL687982 0.85 ALDH1A1 (0.78) ALDH1A1HPGDLMNAHSD17B10KMT2A
SCHEMBL3712310 0.84 PI4KA (0.73) ALDH1A1HPGDLMNAHSD17B10KMT2A
SCHEMBL9722734 0.84 ALDH1A1 (0.71) ALDH1A1HPGDLMNAHSD17B10KMT2A
SCHEMBL464726 0.83 ALDH1A1 (0.76) ALDH1A1HPGDLMNAHSD17B10KMT2A
SCHEMBL1498187 0.83 ALDH1A1 (0.76) ALDH1A1HPGDLMNAHSD17B10KMT2A
SCHEMBL9722822 0.83 ALDH1A1 (0.69) ALDH1A1HPGDLMNAHSD17B10KMT2A
SCHEMBL9722801 0.83 ALDH1A1 (0.69) ALDH1A1HPGDLMNAHSD17B10KMT2A
Hydrochloric Acid SCHEMBL27732230 0.82 ALDH1A1 (0.73) ALDH1A1HPGDLMNAHSD17B10KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114773196-B Purification method of high-carbon methacrylate 辽宁华星日化产业技术研究院有限公司 2024-02-13 CN claimed
CN-115074717-B Metal antioxidant and application thereof in copper wire production 无锡市明星精密线材有限公司 2022-11-18 CN claimed
CN-115074717-A Metal antioxidant and application thereof in copper wire production 无锡市明星精密线材有限公司 2022-09-20 CN claimed
CN-114773196-A Method for purifying methacrylic acid high-carbon ester 辽宁华星日化产业技术研究院有限公司 2022-07-22 CN claimed
EP-2742029-B1 N-(BENZIMIMDAZOL-2-YL)-CYCLOPROPANE CARBOXAMIDES AS LYSOPHOSPHATIDIC ACID ANTAGONISTS MERCK PATENT GMBH (DE) 2016-10-05 EP claimed
US-8912202-B2 N-(benzimimdazol-2-yl)-cyclopropane carboxamides as lysophosphatidic acid antagonists MERCK PATENT GMBH (DE) 2014-12-16 US claimed
US-20140228378-A1 N-(Benzimimdazol-2-yl)-Cyclopropane Carboxamides as Lysophosphatidic Acid Antagonists MERCK PATENT GMBH (DE) 2014-08-14 US claimed
EP-2742029-A1 N-(BENZIMIMDAZOL-2-YL)-CYCLOPROPANE CARBOXAMIDES AS LYSOPHOSPHATIDIC ACID ANTAGONISTS Merck Patent GmbH (DE) 2014-06-18 EP claimed
CN-101528856-B Disperse azo dyes DYSTAR TEXTILFARBEN GMBH & CO 2013-07-03 CN claimed
WO-2013020622-A1 N-(BENZIMIMDAZOL-2-YL)-CYCLOPROPANE CARBOXAMIDES AS LYSOPHOSPHATIDIC ACID ANTAGONISTS MERCK PATENT GMBH (DE) 2013-02-14 WO claimed
CN-101528856-A Disperse azo dyes DYSTAR TEXTILFARBEN GMBH & CO (DE) 2009-09-09 CN claimed
EP-2084232-A1 DISPERSE AZO DYESTUFFS DyStar Textilfarben GmbH & Co. Deutschland KG (DE) 2009-08-05 EP claimed
WO-2008055846-A1 DISPERSE AZO DYESTUFFS DYSTAR TEXTILFARBEN GMBH & CO DEUTSCHLAND KG (DE) 2008-05-15 WO claimed
WO-2004079044-A1 A CORROSION INHIBITING COMPOSITION FOR METALS COLUMBIA CHEMICAL CORPORATION (US) 2004-09-16 WO claimed
US-20040170848-A1 Corrosion inhibiting composition for metals COLUMBIA CHEMICAL CORPORATION 2004-09-02 US claimed
EP-0282971-B1 Substituted 2-aminobenzothiazoles and derivatives useful as cerebrovascular agents WARNER LAMBERT CO (US) 1994-12-28 EP claimed
US-4826860-A STROKES WARNER-LAMBERT COMPANY (US) 1989-05-02 US claimed
EP-0282971-A2 Substituted 2-aminobenzothiazoles and derivatives useful as cerebrovascular agents WARNER-LAMBERT COMPANY (US) 1988-09-21 EP claimed
US-4363913-A Preparation of 2-aminobenzothiazoles EASTMAN KODAK COMPANY (US) 1982-12-14 US claimed
US-4288362-A Monoazo pigments containing a quinazo linonylacetoacetanilide coupling component BAYER AKTIENGESELLSCHAFT (DE) 1981-09-08 US 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 (1 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-20140228378-A1 N-(Benzimimdazol-2-yl)-Cyclopropane Carboxamides as Lysophosphatidic Acid Antagonists LPAR5, LPAR2, LPAR1 ALDH1A1 1766/4885HPGD 891/4885LMNA 1255/4885

“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.