SCHEMBL6480045

SCHEMBL6480045

Cc1[c]cc(C)c(SC#N)c1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.35
USP8 P40818 1/20 0.35
USP5 P45974 1/20 0.35
USP4 Q13107 1/20 0.35
USP7 Q93009 1/20 0.35
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 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
SCHEMBL6479605 0.81 USP2 (0.33) USP2USP8USP5USP4USP7
SCHEMBL6479477 0.78 AR (0.32) USP2USP8USP5USP4USP7
SCHEMBL16707477 0.75 USP2 (0.44) USP2USP8USP5USP4USP7
SCHEMBL11776404 0.74
SCHEMBL16707476 0.72 USP2 (0.41) USP2USP8USP5USP4USP7
SCHEMBL11778277 0.69
SCHEMBL2681698 0.68 TSHR (0.38) ALDH1A1
SCHEMBL19773972 0.67 USP2 (0.38) USP2USP8USP5USP4USP7
SCHEMBL7939185 0.67 MEN1 (0.39) USP2USP8USP5USP4USP7
SCHEMBL11374139 0.67 USP2 (0.47) USP2USP8USP5USP4USP7

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-20050153996-A1 COMPOUNDS THAT MODULATE PPAR ACTIVITY AND METHODS FOR THEIR PREPARATION AUERBACH BRUCE J (US) 2005-07-14 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-20050153996-A1 COMPOUNDS THAT MODULATE PPAR ACTIVITY AND METHODS FOR THEIR PREPARATION GPR119, PPARA, PPARG USP2 3664/4885USP8 3825/4885USP5 3045/4885

“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.