SCHEMBL1472152

SCHEMBL1472152

O=[N+]([O-])c1ccc(Oc2c(Cl)cc(S(=O)(=O)N3CCOCC3)cc2Cl)cc1

nearest known ligand 0.76

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.58
LMNA P02545 4/20 0.58
ALDH1A1 P00352 2/20 0.57
KMT2A Q03164 6/20 0.53
MEN1 O00255 5/20 0.53
HTT P42858 2/20 0.53
RECQL P46063 1/20 0.53
TSHR P16473 1/20 0.52
CYP2C9 P11712 1/20 0.52
FAAH O00519 4/20 0.51
MGLL Q99685 1/20 0.51
MAPT P10636 1/20 0.48

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
SCHEMBL1473871 0.89 ALDH1A1 (0.72) SMN1; SMN2LMNAALDH1A1KMT2AMEN1
SCHEMBL1471260 0.88 ALDH1A1 (0.74) SMN1; SMN2LMNAALDH1A1KMT2AMEN1
SCHEMBL1474049 0.86 LMNA (0.78) SMN1; SMN2LMNAALDH1A1KMT2AMEN1
SCHEMBL1471445 0.86 CYP2C9 (0.69) SMN1; SMN2LMNAALDH1A1KMT2AMEN1
SCHEMBL1471338 0.82 CYP2C9 (0.61) SMN1; SMN2LMNAALDH1A1KMT2AHTT
SCHEMBL2719072 0.81 POLB (0.67) SMN1; SMN2LMNAALDH1A1KMT2AMEN1
SCHEMBL8411987 0.79 SMN1; SMN2 (0.48) SMN1; SMN2LMNAALDH1A1KMT2AMEN1
SCHEMBL1471444 0.78 LMNA (0.60) SMN1; SMN2LMNAALDH1A1KMT2AMEN1
SCHEMBL1472388 0.77 CA2 (0.56) SMN1; SMN2LMNAALDH1A1KMT2AMEN1
SCHEMBL1471984 0.76 LMNA (0.57) SMN1; SMN2LMNAALDH1A1KMT2AMEN1

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 8 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-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
WO-2005007621-A2 UBIQUITIN LIGASE INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2005-01-27 WO 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 SMN1; SMN2 3336/4885LMNA 4028/4885ALDH1A1 1362/4885

“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.