SCHEMBL3618644

SCHEMBL3618644

CC(C)(C)OC(=O)N1CCCN(c2ccc(NS(=O)(=O)c3cccc(F)c3)c(N)c2)CC1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 10/20 0.51
LMNA P02545 2/20 0.47
USP2 O75604 1/20 0.47
ALDH1A1 P00352 1/20 0.47
PKM P14618 1/20 0.47
ALOX15 P16050 1/20 0.47
MAPK1 P28482 1/20 0.47
HTT P42858 1/20 0.47
PIK3CA P42336 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
GPR119 Q8TDV5 1/20 0.44
PDK2 Q15119 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
POLB P06746 1/20 0.42
HTR6 P50406 1/20 0.42
STS P08842 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
SCHEMBL3622976 0.90 TGFBR1 (0.50) TGFBR1PIK3CAGPR119PDK2MEN1
SCHEMBL6741316 0.86 PIK3CA (0.49) TGFBR1LMNAUSP2ALDH1A1PKM
SCHEMBL3616980 0.83 TGFBR1 (0.50) TGFBR1LMNAALDH1A1PIK3CAGPR119
SCHEMBL3619817 0.82 TGFBR1 (0.52) TGFBR1PIK3CAGPR119PDK2MEN1
SCHEMBL6741295 0.80 HTR6 (0.53) TGFBR1LMNAUSP2ALDH1A1PKM
SCHEMBL3621908 0.80 RAD52 (0.60) LMNAUSP2ALDH1A1PKMALOX15
SCHEMBL3622518 0.79 TGFBR1 (0.53) TGFBR1LMNAUSP2ALDH1A1ALOX15
SCHEMBL3613446 0.79 TGFBR1 (0.49) TGFBR1PIK3CAGPR119PDK2MEN1
SCHEMBL3615524 0.78 TGFBR1 (0.49) TGFBR1PIK3CAGPR119PDK2MEN1
SCHEMBL5586223 0.78 TGFBR1 (0.50) TGFBR1PIK3CAGPR119PDK2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7718650-B2 Aryl sulfonamide compounds for treating obesity BIOVITRUM AB (SE) 2010-05-18 US disclosed
US-7566715-B2 Substituted sulfonamide compounds useful for the prophylaxis and treatment of conditions relating to obesity, type II diabetes and/or disorders of the central nervous system BIOVITRUM AB (SE) 2009-07-28 US disclosed
US-20080096873-A1 NEW COMPOUNDS BIOVITRUM AB, A SWEDEN CORPORATION 2008-04-24 US disclosed
US-7319097-B2 Treatment of type II diabetes with benzenesulfonamide substituted with an N-heterocycle: N-[2-amino-5-(1,4-diazepan-1-yl)phenyl]benzenesulfonamide, N-[4-amino-5-(piperazinyl)phenyl]benzenesulfonamide, 3-amino-4-(5-methyl-2,5-diaza-bicyclo[2.2.1]hept-2-yl)-N-phenyl-benzenesulfonamide hydrochloride BIOVITRUM AB (SE) 2008-01-15 US disclosed
US-7173035-B2 Arylsulfonamide compounds BIOVITRUM AB (SE) 2007-02-06 US disclosed
US-20060009446-A1 New compounds BIOVITRUM AB, A SWEDEN CORPORATION 2006-01-12 US disclosed
US-20050288275-A1 New compounds BIOVITRUM AB, A SWEDEN CORPORATION 2005-12-29 US disclosed
US-6969710-B2 Compounds BIOVITRUM AB (SE) 2005-11-29 US disclosed
US-20030149020-A1 New compounds PROXIMAGEN NEUROSCIENCE PLC (GB) 2003-08-07 US disclosed
US-20030149019-A1 New compounds PROXIMAGEN NEUROSCIENCE PLC (GB) 2003-08-07 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 (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-20030149020-A1 New compounds GPR119, SULT2A1, NAT1 TGFBR1 4130/4885LMNA 3478/4885USP2 2236/4885
US-20030149019-A1 New compounds GPR119, SULT2A1, NAT1 TGFBR1 4130/4885LMNA 3478/4885USP2 2236/4885
US-20060009446-A1 New compounds GPR119, SULT2A1, STS TGFBR1 4414/4885LMNA 3475/4885USP2 2128/4885
US-20080096873-A1 NEW COMPOUNDS GPR119, SULT2A1, STS TGFBR1 4414/4885LMNA 3475/4885USP2 2128/4885
US-20050288275-A1 New compounds GPR119, SULT2A1, STS TGFBR1 4414/4885LMNA 3475/4885USP2 2128/4885

“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.