SCHEMBL3556404

SCHEMBL3556404

CCC(CC)c1nc(C=O)cs1

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.38
HTR2B P41595 1/20 0.37
ALDH1A1 P00352 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
SCHEMBL6468247 0.80 MAPT (0.35) MAPTHTR2BALDH1A1
SCHEMBL1051061 0.79 MAPT (0.40) MAPTHTR2BALDH1A1
SCHEMBL2438716 0.79 MAPT (0.41) MAPTHTR2BALDH1A1
SCHEMBL9381730 0.77 MAPT (0.36) MAPTHTR2BALDH1A1
SCHEMBL9568876 0.75 HTR2B (0.40) MAPTHTR2BALDH1A1
SCHEMBL16742562 0.74 MAPT (0.45) MAPTHTR2BALDH1A1
SCHEMBL3549501 0.72 SMN1; SMN2 (0.41) MAPT
SCHEMBL10771875 0.71
SCHEMBL13999711 0.70 MAPT (0.39) MAPTHTR2BALDH1A1
SCHEMBL20130304 0.70 HTR2B (0.35) MAPTHTR2BALDH1A1

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-8163746-B2 Azolecarboxamide derivative ASTELLAS PHARMA INC. (JP) 2012-04-24 US disclosed
US-20090286766-A1 AZOLECARBOXAMIDE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2009-11-19 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-20090286766-A1 AZOLECARBOXAMIDE DERIVATIVE GPR17, NTRK1, TRPV1 MAPT 1330/4885HTR2B 2017/4885ALDH1A1 975/4885

“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.