SCHEMBL5114536

SCHEMBL5114536

Cc1cc(S(=O)(=O)N(C)CCOCC(=O)N(C)Cc2ccc(C3=NCCN3C(=O)O)cc2)ccc1Cl

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 14/20 0.51
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
ABL1 P00519 1/20 0.37
RIN1 Q13671 1/20 0.37
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35

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
SCHEMBL5110400 0.89 BDKRB1 (0.54) BDKRB1NPC1RAB9AMEN1KMT2A
SCHEMBL5118640 0.88 BDKRB1 (0.53) BDKRB1MEN1KMT2AALDH1A1HPGD
SCHEMBL5118079 0.88 BDKRB1 (0.49) BDKRB1MEN1KMT2AALDH1A1HPGD
SCHEMBL5119406 0.86 BDKRB1 (0.69) BDKRB1NPC1RAB9A
SCHEMBL5115130 0.86 BDKRB1 (0.68) BDKRB1ALDH1A1
SCHEMBL5114546 0.86 BDKRB1 (0.40) BDKRB1NPC1RAB9AMEN1KMT2A
SCHEMBL5111217 0.85 BDKRB1 (0.60) BDKRB1ALDH1A1
SCHEMBL5114561 0.85 BDKRB1 (0.50) BDKRB1MEN1KMT2AALDH1A1HPGD
SCHEMBL5118227 0.85 BDKRB1 (0.69) BDKRB1
SCHEMBL5125500 0.85 BDKRB1 (0.59) BDKRB1NPC1RAB9AMEN1KMT2A

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 BDKRB1 1217/4885NPC1 336/4885RAB9A 822/4885

“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.