SCHEMBL3704196

SCHEMBL3704196

O=S(=O)(O)c1cccnc1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
COMT P21964 1/20 0.47
LMNA P02545 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
NFE2L2 Q16236 8/20 0.46
ALDH1A1 P00352 1/20 0.45
CYP1A2 P05177 1/20 0.45
ALOX15 P16050 1/20 0.45
HIF1A Q16665 1/20 0.45
HSD17B10 Q99714 1/20 0.45
ACLY P53396 1/20 0.43
EGFR P00533 1/20 0.41
MEN1 O00255 1/20 0.40
NSD2 O96028 1/20 0.40
POLB P06746 1/20 0.40
IDE P14735 1/20 0.40
DUSP3 P51452 1/20 0.40
CCR6 P51684 1/20 0.40
BLM P54132 1/20 0.40
KMT2A Q03164 1/20 0.40
NPC1 O15118 1/20 0.40

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
Hydrochloric Acid SCHEMBL28073279 0.98 COMT (0.46) COMTLMNASMN1; SMN2NFE2L2ALDH1A1
SCHEMBL3698635 0.98 COMT (0.46) COMTLMNASMN1; SMN2NFE2L2ALDH1A1
SCHEMBL3713453 0.98 COMT (0.46) COMTLMNASMN1; SMN2NFE2L2ALDH1A1
SCHEMBL3698654 0.98 COMT (0.46) COMTLMNASMN1; SMN2NFE2L2ALDH1A1
Quinoline SCHEMBL27999776 0.87 ALDH1A1 (0.53) COMTNFE2L2ALDH1A1CYP1A2HIF1A
Dimethylformamide SCHEMBL27642635 0.87 NFE2L2 (0.41) COMTLMNASMN1; SMN2NFE2L2ALDH1A1
SCHEMBL925929 0.83 NFE2L2 (0.46) LMNASMN1; SMN2NFE2L2ACLY
SCHEMBL31634218 0.83 NFE2L2 (0.46) LMNASMN1; SMN2NFE2L2ACLY
SCHEMBL349118 0.81 TRPV4 (0.51) LMNASMN1; SMN2NFE2L2ALDH1A1HSD17B10
SCHEMBL29435677 0.81 TRPV4 (0.51) LMNASMN1; SMN2NFE2L2ALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2501236-B1 N-[2-fluoro-3-(4-amino-7H-pyrrolo[2,3-d]pyrimidine-5-carbonyl)-phenyl]-4-benzenesulfonamide derivatives as Raf protein kinase modulators for the treatment of cancer PLEXXIKON INC (US) 2017-03-29 EP claimed
CN-103814021-B Dihydroquinoline 2 ketone derivatives 霍夫曼-拉罗奇有限公司 2016-12-21 CN claimed
CN-103517905-B Novel hexahydropyrroloimidazolone compounds 霍夫曼-拉罗奇有限公司 2016-08-24 CN claimed
EP-2707371-B1 NEW HEXAHYDROPYRROLOIMIDAZOLONE COMPOUNDS HOFFMANN LA ROCHE (CH) 2016-04-20 EP claimed
CN-102083797-B Tetrahydroisoquinolines, pharmaceutical compositions containing them and their use in therapy ABBOTT GMBH & CO KG 2014-06-04 CN claimed
CN-103814021-A New dihydroquinoline-2-one derivatives HOFFMANN LA ROCHE 2014-05-21 CN claimed
EP-2707371-A1 NEW HEXAHYDROPYRROLOIMIDAZOLONE COMPOUNDS F.HOFFMANN-LA ROCHE AG (CH) 2014-03-19 EP claimed
CN-103517905-A Novel hexahydropyrroloimidazolone compounds HOFFMANN LA ROCHE 2014-01-15 CN claimed
US-8497288-B2 Hexahydropyrroloimidazolone compounds HOFFMANN-LA ROCHE INC. (US) 2013-07-30 US claimed
CN-101945877-B Pyrrolopyrazine kinase inhibitors HOFFMANN LA ROCHE 2013-07-03 CN claimed
WO-2012152663-A1 NEW HEXAHYDROPYRROLOIMIDAZOLONE COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2012-11-15 WO claimed
US-20120289549-A1 NEW HEXAHYDROPYRROLOIMIDAZOLONE COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2012-11-15 US claimed
US-12036208-B2 Methods for treating neurodegenerative disorders ALZHEON, INC. (US) 2024-07-16 US disclosed
US-11077095-B2 Methods for treating neurodegenerative disorders ALZHEON, INC. (US) 2021-08-03 US disclosed
EP-2460789-B1 METHOD FOR PRODUCING BIARYL COMPOUND SUMITOMO CHEMICAL CO (JP) 2017-04-19 EP disclosed
US-9617267-B2 Compounds and methods for kinase modulation, and indications therefor PLEXXIKON INC. (US) 2017-04-11 US disclosed
EP-1599477-B1 SULFONAMIDE SUBSTITUTED XANTHINE DERIVATIVES FOR USE AS PEPCK INHIBITORS HOFFMANN LA ROCHE (CH) 2008-01-30 EP disclosed
EP-1599477-A1 SULFONAMIDE SUBSTITUTED XANTHINE DERIVATIVES FOR USE AS PEPCK INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2005-11-30 EP disclosed
WO-2004074288-A1 SULFONAMIDE SUBSTITUTED XANTHINE DERIVATIVES FOR USE AS PEPCK INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2004-09-02 WO disclosed
WO-2004069844-A1 NOVEL TRICYCLIC OXAZEPINE DERIVATIVES, METHOD FOR PRODUCTION THEREOF AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME LES LABORATOIRES SERVIER (FR) 2004-08-19 WO 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 (3 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-20120289549-A1 NEW HEXAHYDROPYRROLOIMIDAZOLONE COMPOUNDS LIPC, PNLIP, LIPE COMT 3915/4885LMNA 1627/4885SMN1; SMN2 4851/4885
US-11077095-B2 Methods for treating neurodegenerative disorders NLN, CLN6, SNCA COMT 1672/4885LMNA 542/4885SMN1; SMN2 14/4885
US-12036208-B2 Methods for treating neurodegenerative disorders NLN, CLN6, SNCA COMT 1672/4885LMNA 542/4885SMN1; SMN2 14/4885

“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.