SCHEMBL3633792

SCHEMBL3633792

N#Cc1ccc(S(=O)(=O)N2CCCCC2)cc1

nearest known ligand 0.71

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.71
GAA P10253 7/20 0.60
L3MBTL1 Q9Y468 1/20 0.60
MAPT P10636 2/20 0.59
PKM P14618 1/20 0.58
PKLR P30613 1/20 0.58
EPHX2 P34913 1/20 0.58
TSHR P16473 1/20 0.56
POLB P06746 1/20 0.56
HTT P42858 2/20 0.56
LMNA P02545 1/20 0.56
NPSR1 Q6W5P4 1/20 0.55
ALDH1A1 P00352 2/20 0.55
MEN1 O00255 1/20 0.55
HPGD P15428 1/20 0.55
KMT2A Q03164 1/20 0.55
TDP1 Q9NUW8 1/20 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
SCHEMBL13271173 0.95 USP2 (0.62) USP2GAAL3MBTL1MAPTPKM
SCHEMBL8692256 0.85 ALDH1A1 (0.68) GAAMAPTPOLBHTTLMNA
SCHEMBL15231766 0.84 MAPT (0.65) USP2GAAL3MBTL1MAPTPKM
SCHEMBL12656054 0.83 KMT2A (0.63) USP2GAAL3MBTL1MAPTPKM
SCHEMBL5338240 0.83 POLB (0.67) GAAL3MBTL1PKMPKLRPOLB
Hydrochloric Acid SCHEMBL3246796 0.83 MAPT (0.63) USP2GAAL3MBTL1MAPTPKM
SCHEMBL16627264 0.83 ATM (0.63) USP2GAAL3MBTL1PKMPKLR
SCHEMBL8220120 0.81 GAA (0.56) USP2GAAL3MBTL1MAPTPKM
SCHEMBL13993549 0.80 MEN1 (0.69) GAAL3MBTL1MAPTPKMPKLR
SCHEMBL3629646 0.80 ALDH1A1 (0.61) USP2GAAL3MBTL1MAPTTSHR

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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117730077-A 6-substituted naphthalene-1, 3-disulfonic acid derivatives as modulators of extracellular nicotinamide ribophosphate transferase (ENAMPT) for the treatment of, for example, diabetes 曼彻斯特大学 2024-03-19 CN disclosed
WO-2023007147-A1 6-SUBSTITUTED NAPHTHALENE-1,3-DISULFONIC ACID DERIVATIVES AS MODULATORS OF THE EXTRACELLULAR NICOTINAMIDE PHOSPHORIBOSYL TRANSFERASE (ENAMPT) FOR THE TREATMENT OF E.G. DIABETES THE UNIVERSITY OF MANCHESTER (GB) 2023-02-02 WO disclosed
US-20210380546-A1 VACCINE ADJUVANT THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2021-12-09 US disclosed
US-10696692-B2 Amido-benzyl sulfone and sulfoxide derivates Valo Health, LLC 2020-06-30 US disclosed
US-10196373-B2 Substituted 2-hydroxy-4-(2-(phenylsulfonamido)acetamido)benzoic acid analogs as inhibitors of STAT protein THE GOVERNING COUNCIL OF THE UNIVERSITY OF TORONTO (CA) 2019-02-05 US disclosed
US-20150104384-A1 AMIDO-BENZYL SULFONE AND SULFOXIDE DERIVATIVES VALO HEALTH, INC. 2015-04-16 US disclosed
EP-2820018-A1 AMIDO-BENZYL SULFONE AND SULFOXIDE DERIVATIVES Genentech, Inc. (US) 2015-01-07 EP disclosed
WO-2013127266-A1 AMIDO-BENZYL SULFONE AND SULFOXIDE DERIVATIVES GENENTECH, INC. (US) 2013-09-06 WO disclosed
WO-2013007768-A1 TRICYCLIC HETEROCYCLIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF AS JAK INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2013-01-17 WO disclosed
EP-2144890-A1 METHOD FOR PREPARING HALOGENATED AMINES Wyeth (US) 2010-01-20 EP disclosed
WO-2008098103-A1 METHOD FOR PREPARING HALOGENATED AMINES WYETH (US) 2008-08-14 WO disclosed
US-20080188659-A1 Method for Preparing Halogenated Amines WYETH (US) 2008-08-07 US disclosed
US-20080188659-A1 Method for Preparing Halogenated Amines WYETH (US) 2008-08-07 US disclosed
US-20080188659-A1 Method for Preparing Halogenated Amines WYETH (US) 2008-08-07 US disclosed
EP-1037886-B1 TRIAZINE ANGIOGENESIS INHIBITORS ABBOTT LAB (US) 2003-05-02 EP disclosed
US-6288228-B1 DIAMINOTRIAZINE DERIVATIVES ABBOTT LABORATORIES 2001-09-11 US disclosed
US-6150362-A ADMINISTERING 1,3,5-SUBSTITUTED TRIAZINE COMPOUNDS TO THE PATIENT SUFFERING FROM ANGIOGENIC DISEASES ABBVIE INC. 2000-11-21 US disclosed
EP-1037886-A1 TRIAZINE ANGIOGENESIS INHIBITORS Abbott Laboratories (US) 2000-09-27 EP disclosed
WO-1999031088-A1 TRIAZINE ANGIOGENESIS INHIBITORS ABBOTT LABORATORIES (US) 1999-06-24 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 (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-20080188659-A1 Method for Preparing Halogenated Amines PNMT, ABL1, INMT USP2 743/4885GAA 2501/4885L3MBTL1 3280/4885
US-10696692-B2 Amido-benzyl sulfone and sulfoxide derivates STS, SQOR, SULT1E1 USP2 3157/4885GAA 1180/4885L3MBTL1 3680/4885
US-20210380546-A1 VACCINE ADJUVANT IFNG, TLR9, LY96 USP2 3978/4885GAA 2120/4885L3MBTL1 3199/4885
US-10196373-B2 Substituted 2-hydroxy-4-(2-(phenylsulfonamido)acetamido)benzoic acid analogs as inhibitors of STAT protein STAT3, STAT1, STAT4 USP2 638/4885GAA 949/4885L3MBTL1 2601/4885
US-20150104384-A1 AMIDO-BENZYL SULFONE AND SULFOXIDE DERIVATIVES STS, SULT1E1, CBS USP2 3457/4885GAA 1131/4885L3MBTL1 3957/4885

“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.