SCHEMBL5877382

SCHEMBL5877382

Cc1ccc(S(=O)(=O)n2nc(NC3CC3)c3c2CC(c2ccccc2)(c2cscn2)C=C3)cc1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.34
SCN1A P35498 1/20 0.33
SCN8A Q9UQD0 1/20 0.33
CCR6 P51684 2/20 0.31
GPR6 P46095 2/20 0.31
NR1H2 P55055 1/20 0.31
NR1H3 Q13133 1/20 0.31
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
KMT2A Q03164 1/20 0.30
RAB9A P51151 1/20 0.30
GAA P10253 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
SCHEMBL5876077 0.97 GBA1 (0.33) GBA1SCN1ASCN8ACCR6NR1H2
SCHEMBL5876012 0.89 NR1H2 (0.36) CCR6GPR6NR1H2NR1H3MEN1
SCHEMBL5877113 0.89 GBA1 (0.34) GBA1NR1H2NR1H3MEN1KMT2A
SCHEMBL5876223 0.88 SMN1; SMN2 (0.33) CCR6GPR6NR1H2NR1H3MEN1
SCHEMBL5876287 0.87 NR1H2 (0.32) CCR6GPR6NR1H2NR1H3MEN1
SCHEMBL5876198 0.86 USP2 (0.37) CCR6NR1H2NR1H3MEN1ALDH1A1
SCHEMBL5876624 0.86 CCR6 (0.33) CCR6NR1H2NR1H3MEN1ALDH1A1
SCHEMBL5876220 0.85 NR1H2 (0.34) GBA1CCR6GPR6NR1H2NR1H3
SCHEMBL5876863 0.85 GBA1 (0.36) GBA1NR1H2NR1H3MEN1ALDH1A1
SCHEMBL5877411 0.85 NR1H2 (0.33) GBA1CCR6GPR6NR1H2NR1H3

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-7119115-B2 Indazole or indole derivatives, and use thereof in human medicine and more particularly in oncology AVENTIS PHARMA S.A. (FR) 2006-10-10 US disclosed
US-20040162276-A1 Indazole or indole derivatives, and use thereof in human medicine and more particularly in oncology AVENTIS PHARMA S.A. (FR) 2004-08-19 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-20040162276-A1 Indazole or indole derivatives, and use thereof in human medicine and more particularly in oncology IDO1, IDO2, INMT GBA1 2736/4885SCN1A 2914/4885SCN8A 4592/4885

“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.