SCHEMBL5114367

SCHEMBL5114367

CN(Cc1ccc(C2=NCCN2C(=O)O)cc1)C(=O)CCCCNCS(=O)(=O)c1c(Cl)cccc1Cl

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 5/20 0.38
HTT P42858 2/20 0.33
KMT2A Q03164 1/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
TP53 P04637 1/20 0.32
DGAT1 O75907 1/20 0.32
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL5125281 0.94 BDKRB1 (0.39) BDKRB1HTTKMT2ANPC1RAB9A
SCHEMBL5126334 0.91 BDKRB1 (0.40) BDKRB1NPC1RAB9ATP53DGAT1
SCHEMBL5126495 0.91 BDKRB1 (0.38) BDKRB1HTTKMT2ANPC1RAB9A
SCHEMBL5119110 0.89 BDKRB1 (0.40) BDKRB1NPC1RAB9ATP53DGAT1
SCHEMBL5119727 0.88 BDKRB1 (0.38) BDKRB1HTTKMT2ANPC1RAB9A
SCHEMBL5115133 0.87 BDKRB1 (0.49) BDKRB1HTTKMT2AALDH1A1
SCHEMBL5117876 0.87 BDKRB1 (0.38) BDKRB1HTTKMT2ARAB9ATP53
SCHEMBL6762653 0.86 BDKRB1 (0.40) BDKRB1HTTKMT2AALDH1A1
SCHEMBL5124690 0.86 LMNA (0.41) BDKRB1KMT2ANPC1RAB9ATP53
SCHEMBL5118636 0.85 BDKRB1 (0.41) BDKRB1NPC1RAB9ATP53ALDH1A1

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 1217/4885HTT 2903/4885KMT2A 3755/4885

“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.