SCHEMBL7549649

SCHEMBL7549649

Cc1ncsc1S(=O)(=O)Nc1ccccc1NC(=O)Nc1ccccc1Br.O=C1CN1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 6/20 0.40
MEN1 O00255 6/20 0.40
KMT2A Q03164 6/20 0.40
MAPT P10636 5/20 0.40
GAA P10253 2/20 0.40
CASP3 P42574 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
IDH1 O75874 1/20 0.39
LMNA P02545 5/20 0.38
RAB9A P51151 3/20 0.38
NPC1 O15118 2/20 0.38
MAPK1 P28482 2/20 0.36
POLB P06746 1/20 0.36
CXCR2 P25025 4/20 0.35
CXCR1 P25024 3/20 0.35
CA2 P00918 1/20 0.35
CA4 P22748 1/20 0.35
CA9 Q16790 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
SCHEMBL5594948 0.72 RORA (0.53) HTTMEN1KMT2AMAPTGAA
SCHEMBL5594799 0.66 GAA (0.63) MEN1KMT2AMAPTGAAPOLB
SCHEMBL5594860 0.66 CXCR1 (0.58) HTTMEN1KMT2AMAPTGAA
SCHEMBL5595046 0.65 HTT (0.60) HTTMEN1KMT2AGAALMNA
SCHEMBL13235126 0.65 HTT (0.81) HTTMEN1KMT2AMAPTGAA
SCHEMBL5595166 0.64 MCL1 (0.54) HTTMEN1KMT2AMAPTGAA
SCHEMBL5595863 0.64 MEN1 (0.49) HTTMEN1KMT2AMAPTGAA
SCHEMBL7951681 0.63 PTGES2 (0.59) HTTMEN1KMT2AMAPTGAA
SCHEMBL7552185 0.63 ACLY (0.53) HTTMEN1KMT2AMAPTGAA
SCHEMBL5595427 0.63 CA12 (0.52) HTTMEN1KMT2ALMNARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020128321-A1 IL-8 receptor antagonists SMITHKLINE BEECHAM CORPORATION 2002-09-12 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-20020128321-A1 IL-8 receptor antagonists CXCL8, CCR8, IL1RN HTT 3161/4885MEN1 4754/4885KMT2A 3978/4885

“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.