SCHEMBL5114110

SCHEMBL5114110

O=C(C=CCNCS(=O)(=O)c1cc(Cl)ccc1Cl)CNCc1ccc(C2=NCCN2C(=O)O)cc1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.34
MEN1 O00255 2/20 0.34
GRM5 P41594 1/20 0.32
NAMPT P43490 1/20 0.31
CETP P11597 1/20 0.31
KDM2B Q8NHM5 1/20 0.30
RORC P51449 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL5114593 0.94 GRM5 (0.33) KMT2AMEN1GRM5NAMPTCETP
SCHEMBL5114209 0.91 GRM4 (0.34) KMT2AMEN1ALDH1A1
SCHEMBL5111525 0.90 LMNA (0.32) KMT2AMEN1
SCHEMBL5118806 0.89 LMNA (0.41) KMT2AMEN1
SCHEMBL5124195 0.88 MEN1 (0.36) KMT2AMEN1NAMPT
SCHEMBL5114365 0.88 LMNA (0.34) KMT2AMEN1
SCHEMBL5118936 0.88 LMNA (0.41) KMT2AMEN1
SCHEMBL5117608 0.88 SMN1; SMN2 (0.30)
SCHEMBL5124610 0.86 KMT2A (0.30) KMT2AMEN1
SCHEMBL5111650 0.86 TP53 (0.35) KMT2AMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7361687-B2 Arylsulphonamide derivatives and methods of preparing LABORATOIRES FOURNIER SA (FR) 2008-04-22 US disclosed
US-20060084699-A1 Novel arylsulphonamide derivatives and use thereof as therapeutic agents LABORATOIRES FOURNIER SA (FR) 2006-04-20 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-20060084699-A1 Novel arylsulphonamide derivatives and use thereof as therapeutic agents UGT1A1, UGT2B7, UGT1A6 KMT2A 3755/4885MEN1 4618/4885GRM5 3005/4885

“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.