SCHEMBL5877113

SCHEMBL5877113

Cc1ccc(S(=O)(=O)n2nc(Nc3ccccc3)c3c2CC(c2ccccc2)(c2cscn2)C=C3)cc1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.34
NR1H2 P55055 1/20 0.32
NR1H3 Q13133 1/20 0.32
GAA P10253 2/20 0.31
CYP2C19 P33261 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL5875996 0.89 NR1H2 (0.38) NR1H2NR1H3GAACYP2C19MEN1
SCHEMBL5877382 0.89 GBA1 (0.34) GBA1NR1H2NR1H3GAAMEN1
SCHEMBL5877823 0.87 NR1H2 (0.33) NR1H2NR1H3GAACYP2C19MEN1
SCHEMBL5876077 0.87 GBA1 (0.33) GBA1NR1H2NR1H3
SCHEMBL5876902 0.87 NR1H2 (0.33) NR1H2NR1H3GAACYP2C19MEN1
SCHEMBL5876863 0.86 GBA1 (0.36) GBA1NR1H2NR1H3GAACYP2C19
SCHEMBL5877420 0.85 NR1H2 (0.32) NR1H2NR1H3GAACYP2C19MEN1
SCHEMBL5877755 0.85 GBA1 (0.35) GBA1NR1H2NR1H3GAACYP2C19
SCHEMBL5876451 0.85 NR1H2 (0.34) NR1H2NR1H3GAACYP2C19MEN1
SCHEMBL5877764 0.85 NR1H2 (0.35) GBA1NR1H2NR1H3GAACYP2C19

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 2736/4885NR1H2 556/4885NR1H3 456/4885

“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.