SCHEMBL3500902

SCHEMBL3500902

CCC(C(=O)O)C1CN=C(c2cc3cccc(N(CC)S(=O)(=O)c4cccs4)c3[nH]2)S1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.34
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TSHR P16473 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
SCHEMBL3498324 0.93 MAPT (0.33) MAPTNPSR1
SCHEMBL3501468 0.92 MEN1 (0.31) MAPTKMT2AMEN1NPSR1TSHR
SCHEMBL3500973 0.92 MEN1 (0.31) MAPTKMT2AMEN1NPSR1
SCHEMBL3498993 0.91 MAPT (0.31) MAPT
SCHEMBL3499830 0.86 L3MBTL1 (0.32) MAPTNPSR1
SCHEMBL2661012 0.85 MAPT (0.35) MAPTKMT2AMEN1NPSR1TSHR
SCHEMBL3499992 0.84 NFKBIA (0.38) MAPTKMT2AMEN1
SCHEMBL2978318 0.83 MAPT (0.34) MAPTKMT2AMEN1NPSR1TSHR
SCHEMBL2661009 0.83 MAPT (0.34) MAPTKMT2AMEN1NPSR1TSHR
SCHEMBL2668859 0.83 MAPT (0.35) MAPTKMT2AMEN1NPSR1TSHR

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-8410087-B2 Indole compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-04-02 US disclosed
US-20100144702-A1 INDOLE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-06-10 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-20100144702-A1 INDOLE COMPOUND GCKR, GPR119, SLC5A1 MAPT 4224/4885KMT2A 507/4885MEN1 2138/4885

“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.