SCHEMBL922778

SCHEMBL922778

Nc1cccc(S(=O)(=O)CCO)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.58
TSHR P16473 1/20 0.58
HSD17B10 Q99714 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
LMNA P02545 1/20 0.57
CA2 P00918 6/20 0.55
CA12 O43570 2/20 0.55
CA1 P00915 2/20 0.55
CA4 P22748 2/20 0.55
CA9 Q16790 2/20 0.55
CA14 Q9ULX7 1/20 0.55
F2 P00734 3/20 0.50
PRSS1 P07477 3/20 0.50
PRSS2 P07478 3/20 0.50
PRSS3 P35030 3/20 0.50
CYP19A1 P11511 1/20 0.46
POLB P06746 2/20 0.45
PRMT1 Q99873 1/20 0.43
PKLR P30613 1/20 0.42
PKM P14618 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
SCHEMBL29656296 1.00 ALDH1A1 (0.58) ALDH1A1TSHRHSD17B10TDP1LMNA
Hydrochloric Acid SCHEMBL1144014 0.98 ALDH1A1 (0.56) ALDH1A1TSHRHSD17B10TDP1LMNA
Phosphoric Acid SCHEMBL11704340 0.93 ALDH1A1 (0.51) ALDH1A1TSHRHSD17B10TDP1LMNA
Sulfanilamide SCHEMBL8472428 0.89 CA2 (0.63) ALDH1A1TSHRHSD17B10TDP1LMNA
SCHEMBL10778942 0.85 ALDH1A1 (0.62) ALDH1A1TSHRHSD17B10TDP1LMNA
SCHEMBL13989387 0.84 ALDH1A1 (0.49) ALDH1A1TSHRHSD17B10TDP1LMNA
SCHEMBL1965280 0.84 ALDH1A1 (0.61) ALDH1A1TSHRHSD17B10TDP1LMNA
L-Phenylalaninol SCHEMBL8201376 0.83 PRMT1 (0.44) ALDH1A1TSHRHSD17B10TDP1LMNA
SCHEMBL10603340 0.82 POLB (0.62) ALDH1A1TSHRHSD17B10TDP1LMNA
SCHEMBL4392802 0.81 LMNA (0.57) ALDH1A1TSHRHSD17B10TDP1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100166765-A1 BENZOQUINAZOLINE DERIVATIVES NOVARTIS AG (CH) 2010-07-01 US claimed
EP-1451160-B1 PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN ICAGEN INC (US) 2010-01-13 EP claimed
EP-1761541-B1 PYRRAZOLO-PYRIMIDINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2008-01-09 EP claimed
EP-1761541-A1 PYRRAZOLO-PYRIMIDINE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2007-03-14 EP claimed
WO-2005123738-A1 PYRRAZOLO-PYRIMIDINE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2005-12-29 WO claimed
US-6172261-B1 BIOSYNTHESIS USING CHAIN EXTENSION ORIDIGM CORPORATION 2001-01-09 US claimed
CN-1030984-C Method for preparing amino aryl-beta-sulfatoethyl sulfone HOECHST AG (DE) 1996-02-14 CN claimed
US-5463100-A Spraying a mixture of an aminoaryl beta-hydroxyethylsulfone and sulfuric acid into a hot gas stream; drying, esterification and any hydrolysis take place simultaneously; granules HOECHST AKTIENGESELLSCHAFT (DE) 1995-10-31 US claimed
EP-0390826-B1 PROCESS FOR PRODUCING AMINOARYL-BETA-SULPHATOETHYLSULPHONE COMPOUNDS HOECHST AKTIENGESELLSCHAFT (DE) 1992-11-19 EP claimed
CN-1033867-A CIGARETTE LIGHTER TDK CORP (JP) 1989-07-12 CN claimed
US-4450114-A Process for production of sulfuric acid semiesters SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1984-05-22 US claimed
US-4372892-A Process for the preparation of 1-aminobenzene-5-β-sulfatoethylsulfone-2,4-disulfonic acid, the 5-vinylsulfone compound and the alkali salts thereof HOECHST AKTIENGESELLSCHAFT (DE) 1983-02-08 US claimed
JP-3038562-A None JP disclosed
JP-63039854-A None JP disclosed
CN-114921113-B Green and environment-friendly production process of active anthraquinone turquoise blue dye 浙江亿得新材料股份有限公司 2023-08-11 CN disclosed
CN-114014912-B Method for preparing leuprorelin by combining solid phase and liquid phase 浙江湃肽生物有限公司南京分公司 2022-03-29 CN disclosed
US-4066638-A WATER-SOLUBLE FIBER REACTIVE PHENYL-AZO-NAPHTHYL DYESTUFFS CONTAINING TWO SULFO GROUPS IN THE PHENYL MOIETY HOECHST AKTIENGESELLSCHAFT (DT) 1978-01-03 US disclosed
US-4033980-A Phthalocyanine dyestuffs and process for preparing them HOECHST AKTIENGESELLSCHAFT (DT) 1977-07-05 US disclosed
US-4002606-A FIBER-REACTIVE DYES HOECHST AKTIENGESELLSCHAFT (DT) 1977-01-11 US disclosed
US-3980677-A Anthraquinone dyestuffs containing sulphonic acid groups BAYER AKTIENGESELLSCHAFT (DT) 1976-09-14 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 (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-20100166765-A1 BENZOQUINAZOLINE DERIVATIVES CACNA1A, BMP4, TPX2 ALDH1A1 3966/4885TSHR 2266/4885HSD17B10 4016/4885

“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.