SCHEMBL1471626

SCHEMBL1471626

CC(=O)c1cccc(NS(=O)(=O)c2ccc(Oc3ccc([N+](=O)[O-])cc3)cc2)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.66
KMT2A Q03164 5/20 0.66
MAPT P10636 5/20 0.66
SMN1; SMN2 Q16637 5/20 0.66
LMNA P02545 4/20 0.66
MAPK1 P28482 1/20 0.66
ALDH1A1 P00352 5/20 0.57
KDM4E B2RXH2 4/20 0.57
HPGD P15428 3/20 0.57
HTT P42858 2/20 0.57
GAA P10253 1/20 0.57
TCF4 P15884 2/20 0.56
CTNNB1 P35222 2/20 0.56
KDM1A O60341 2/20 0.56
MAOA P21397 2/20 0.56
NPSR1 Q6W5P4 2/20 0.55
ALOX12 P18054 1/20 0.55
PGR P06401 1/20 0.54
CA12 O43570 1/20 0.53
CA2 P00918 1/20 0.53

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
SCHEMBL23093376 0.93 KDM1A (0.62) MEN1KMT2AMAPTSMN1; SMN2LMNA
SCHEMBL23093556 0.82 ALDH1A1 (0.62) MEN1KMT2AMAPTSMN1; SMN2LMNA
SCHEMBL1472101 0.81 MEN1 (0.72) MEN1KMT2AMAPTSMN1; SMN2LMNA
SCHEMBL1471227 0.81 MAPT (0.72) MEN1KMT2AMAPTSMN1; SMN2LMNA
SCHEMBL10955864 0.81 KDM1A (0.62) MEN1KMT2AMAPTSMN1; SMN2LMNA
SCHEMBL11427008 0.81 ATIC (0.65) MEN1KMT2AMAPTSMN1; SMN2LMNA
SCHEMBL13265854 0.81 CASP3 (0.54) MEN1KMT2AMAPTSMN1; SMN2LMNA
SCHEMBL1472241 0.80 MEN1 (1.00) MEN1KMT2AMAPTSMN1; SMN2LMNA
SCHEMBL23093411 0.80 KDM1A (0.61) MEN1KMT2AMAPTSMN1; SMN2LMNA
SCHEMBL1472466 0.79 MEN1 (0.57) MEN1KMT2AMAPTSMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7915293-B2 Carbocyclic and heterocyclic sulfonamide derivatives, e.g., N-(2-bromo-5-(trifluoromethoxy)phenyl)-3,5-dichloro-4-(2-chloro-4-nitrophenoxy)benzenesulfonamide and 4-(2-(trifluoromethyl)phenoxy)-1-(3-trifluoromethyl)phenylsulfonyl)piperidine; treating proliferative diseases RIGEL PHARMACEUTICALS, INC. (US) 2011-03-29 US claimed
EP-1651595-A2 UBIQUITIN LIGASE INHIBITORS Rigel Pharmaceuticals, Inc. (US) 2006-05-03 EP claimed
WO-2005007621-A2 UBIQUITIN LIGASE INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2005-01-27 WO claimed
US-20050009871-A1 Ubiquitin ligase inhibitors RIGEL PHARMACEUTICALS, INC. 2005-01-13 US claimed
US-7915293-B2 Carbocyclic and heterocyclic sulfonamide derivatives, e.g., N-(2-bromo-5-(trifluoromethoxy)phenyl)-3,5-dichloro-4-(2-chloro-4-nitrophenoxy)benzenesulfonamide and 4-(2-(trifluoromethyl)phenoxy)-1-(3-trifluoromethyl)phenylsulfonyl)piperidine; treating proliferative diseases RIGEL PHARMACEUTICALS, INC. (US) 2011-03-29 US disclosed
US-20050009871-A1 Ubiquitin ligase inhibitors RIGEL PHARMACEUTICALS, INC. 2005-01-13 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 (1 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-20050009871-A1 Ubiquitin ligase inhibitors NEDD4, STUB1, UBE3A MEN1 3441/4885KMT2A 1014/4885MAPT 1796/4885

“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.