SCHEMBL4655484

SCHEMBL4655484

CNc1ccc(S(=O)(=O)N2CCCCC2)cc1

nearest known ligand 0.71

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.71
ALDH1A1 P00352 5/20 0.68
HSD17B10 Q99714 1/20 0.60
GAA P10253 3/20 0.60
HTT P42858 2/20 0.60
LMNA P02545 2/20 0.60
KMT2A Q03164 3/20 0.59
MEN1 O00255 2/20 0.59
KDM4E B2RXH2 2/20 0.59
MAPT P10636 2/20 0.59
TP53 P04637 1/20 0.59
ALOX15 P16050 1/20 0.59
RECQL P46063 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.58
GLA P06280 1/20 0.58
TSHR P16473 1/20 0.57
CYP1A2 P05177 1/20 0.57
CYP3A4 P08684 1/20 0.57
CYP2C9 P11712 1/20 0.57

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
SCHEMBL14283239 0.98 ALDH1A1 (0.70) USP2ALDH1A1HSD17B10GAAHTT
SCHEMBL13982817 0.95 ALDH1A1 (0.65) USP2ALDH1A1HSD17B10HTTLMNA
SCHEMBL14094061 0.83 L3MBTL1 (0.68) ALDH1A1HSD17B10GAALMNAKMT2A
SCHEMBL16809210 0.83 MAPT (0.63) USP2ALDH1A1MAPT
SCHEMBL13982806 0.83 USP2 (0.67) USP2ALDH1A1HSD17B10GAAHTT
SCHEMBL12793711 0.82 USP2 (0.71) USP2ALDH1A1HSD17B10GAAHTT
SCHEMBL6945990 0.82 USP2 (0.71) USP2ALDH1A1HSD17B10GAAHTT
SCHEMBL4655481 0.82 USP2 (0.71) USP2ALDH1A1HSD17B10GAAHTT
SCHEMBL4070839 0.80 ALDH1A1 (0.84) USP2ALDH1A1GAAHTTLMNA
SCHEMBL14057770 0.80 KMT2A (0.51) ALDH1A1HTTLMNAKMT2AMEN1

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
WO-2020028482-A1 SMALL MOLECULES THAT SENSITIZE HIV-1 INFECTED CELLS TO ANTIBODY DEPENDENT CELLULAR CYTOTOXICITY THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2020-02-06 WO disclosed
EP-2258356-B1 CHEMICAL COMPOUNDS HAVING ANTIVIRAL ACTIVITY AGAINST DENGUE VIRUS AND OTHER FLAVIVIRUSES CT INGENIERIA GENETICA BIOTECNOLOGIA (CU) 2017-09-27 EP disclosed
CN-103384668-B compounds and compositions for inhibition of NAMPT 福马TM有限责任公司 2017-05-31 CN disclosed
US-8975399-B2 Benzenesulfon amide-compound treatment of a pathological condition linked to an excessive effect of TNF VAX-CONSULTING (FR) 2015-03-10 US disclosed
US-8975399-B2 Benzenesulfon amide-compound treatment of a pathological condition linked to an excessive effect of TNF VAX-CONSULTING (FR) 2015-03-10 US disclosed
US-20130123266-A1 TREATMENT OF A PATHOLOGY LINKED TO AN EXCESSIVE EFFECT OF TNF WITH A BENZENE SULPHONAMIDE COMPOUND VAX-CONSULTING (FR) 2013-05-16 US disclosed
US-20130123266-A1 TREATMENT OF A PATHOLOGY LINKED TO AN EXCESSIVE EFFECT OF TNF WITH A BENZENE SULPHONAMIDE COMPOUND VAX-CONSULTING (FR) 2013-05-16 US disclosed
EP-1673086-B1 4-AMINOQUINOLINE-3-CARBOXAMIDE DERIVATIVES AS PDE4 INHIBITORS GLAXO GROUP LTD (GB) 2008-01-23 EP disclosed
US-20080015183-A1 SUBSTITUTED QUINAZOLIN-4-YLAMINE ANALOGUES NEUROGEN CORPORATION (US) 2008-01-17 US disclosed
US-7304059-B2 Substituted quinazolin-4-ylamine analogues NEUROGEN CORPORATION (US) 2007-12-04 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-20080015183-A1 SUBSTITUTED QUINAZOLIN-4-YLAMINE ANALOGUES PIGS, HRH4, GPR88 USP2 3877/4885ALDH1A1 2125/4885HSD17B10 4462/4885
US-20130123266-A1 TREATMENT OF A PATHOLOGY LINKED TO AN EXCESSIVE EFFECT OF TNF WITH A BENZENE SULPHONAMIDE COMPOUND TNF, TNFRSF1A, TRAF6 USP2 1074/4885ALDH1A1 205/4885HSD17B10 1595/4885

“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.