SCHEMBL330045

SCHEMBL330045

CN(C)c1ccc(S(N)(=O)=O)cc1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 16/20 0.78
CA9 Q16790 12/20 0.78
CA12 O43570 9/20 0.78
MEN1 O00255 1/20 0.78
NPC1 O15118 1/20 0.78
POLB P06746 1/20 0.78
RAB9A P51151 1/20 0.78
KMT2A Q03164 1/20 0.78
CA1 P00915 12/20 0.72
CA7 P43166 5/20 0.66
PTGS2 P35354 3/20 0.64
PTGS1 P23219 1/20 0.64
CA4 P22748 3/20 0.60
CA5A P35218 4/20 0.56
CA5B Q9Y2D0 4/20 0.56
CA6 P23280 2/20 0.56
CA3 P07451 1/20 0.56
ALDH1A1 P00352 3/20 0.55
ALOX15 P16050 2/20 0.55
HSD17B10 Q99714 2/20 0.55

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
SCHEMBL8492321 0.94 CA2 (0.70) CA2CA9CA12MEN1NPC1
SCHEMBL42643 0.88 CA2 (1.00) CA2CA9CA12MEN1NPC1
SCHEMBL42659 0.88 CA2 (1.00) CA2CA9CA12MEN1NPC1
SCHEMBL6726371 0.85 CA2 (0.62) CA2CA9CA12MEN1NPC1
SCHEMBL13242579 0.84 CA2 (1.00) CA2CA9CA12MEN1NPC1
SCHEMBL6732051 0.82 CA2 (0.57) CA2CA9CA12MEN1NPC1
SCHEMBL29283437 0.82 CA2 (0.67) CA2CA9CA12MEN1NPC1
SCHEMBL6721636 0.81 PTGS2 (0.69) CA2CA9CA12MEN1NPC1
SCHEMBL28884814 0.81 CA2 (1.00) CA2CA9CA12MEN1NPC1
SCHEMBL25033772 0.80 CA2 (0.64) CA2CA9CA12MEN1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2000023444-A1 5,7-DISUBSTITUTED-4-AMINOPYRIDO[2,3-D]PYRIMIDINE COMPOUNDS ABBOTT LABORATORIES (US) 2000-04-27 WO claimed
JP-10239908-A None JP disclosed
CN-119738506-B Method for improving quality detection of busulfan injection 广州艾奇西医药科技有限公司 2025-06-24 CN disclosed
CN-119738506-A Method for improving quality control of busulfan injection 广州艾奇西医药科技有限公司 2025-04-01 CN disclosed
CN-112262129-B Triazacyclododecanesulfonamide (\"TCD\") based protein secretion inhibitors 科智生命科学公司 2024-05-14 CN disclosed
WO-2023154528-A1 STEREOSELECTIVE TECHNOLOGIES FOR CHIRAL COMPOUNDS WAVE LIFE SCIENCES LTD. (SG) 2023-08-17 WO disclosed
US-11718641-B2 Bile acid derivatives as FXR/TGR5 agonists and methods of use thereof ENANTA PHARMACEUTICALS, INC. (US) 2023-08-08 US disclosed
US-11718641-B2 Bile acid derivatives as FXR/TGR5 agonists and methods of use thereof ENANTA PHARMACEUTICALS, INC. (US) 2023-08-08 US disclosed
WO-2023091644-A2 HSD17B13-RELATED DOUBLE STRANDED OLIGONUCLEOTIDE COMPOSITIONS AND METHODS RELATING THERETO WAVE LIFE SCIENCES LTD. (SG) 2023-05-25 WO disclosed
WO-2023049218-A1 DOUBLE STRANDED OLIGONUCLEOTIDE COMPOSITIONS AND METHODS RELATING THERETO WAVE LIFE SCIENCES LTD. (SG) 2023-03-30 WO disclosed
US-20010044553-A1 Novel compound for color-producing composition, and recording material CHEMIPRO KASEI KAISHA, LTD. (JP) 2001-11-22 US disclosed
WO-2000023444-A1 5,7-DISUBSTITUTED-4-AMINOPYRIDO[2,3-D]PYRIMIDINE COMPOUNDS ABBOTT LABORATORIES (US) 2000-04-27 WO disclosed
JP-H10239908-A NEGATIVELY CHARGEABLE TONER SHIKOKU CHEM CORP 1998-09-11 JP disclosed
US-5541186-A ENDOTHELIN RECEPTOR INHIBITORS HOFFMANN-LA ROCHE INC. (US) 1996-07-30 US disclosed
US-5529999-A SULFONAMIDOQUINOXALINE DERIVATIVE ELI LILLY AND COMPANY (US) 1996-06-25 US disclosed
EP-0672662-A1 Quinoxaline derivative used in the treatment of tumours ELI LILLY AND COMPANY (US) 1995-09-20 EP disclosed
US-5234955-A N-phenyl-N*-substituted phenylsulfonylureas ELI LILLY AND COMPANY (US) 1993-08-10 US disclosed
EP-0550157-A1 Antitumor compositions and methods of treatment ELI LILLY AND COMPANY (US) 1993-07-07 EP disclosed
EP-0427929-A2 Heat-sensitive recording material MITSUBISHI PAPER MILLS, LTD. (JP) 1991-05-22 EP disclosed
US-3971769-A NATURAL AND SYNTHETIC POLYAMIDES, CELLULOSE ACETATE CROMPTON & KNOWLES CORPORATION (US) 1976-07-27 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 (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-20010044553-A1 Novel compound for color-producing composition, and recording material UROD, UMPS, UGT1A10 CA2 1209/4885CA9 536/4885CA12 436/4885
US-11718641-B2 Bile acid derivatives as FXR/TGR5 agonists and methods of use thereof GPBAR1, NR1H4, SLC10A1 CA2 2269/4885CA9 1912/4885CA12 2989/4885

“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.