SCHEMBL4249933

SCHEMBL4249933

CCOC(=O)CN1C(=O)COc2ccc(C(C)=O)cc21

nearest known ligand 0.73

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.73
USP2 O75604 1/20 0.73
TSHR P16473 2/20 0.55
MAPT P10636 2/20 0.54
ALOX15 P16050 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
PLK1 P53350 1/20 0.52
KMT2A Q03164 1/20 0.49
ALDH1A1 P00352 1/20 0.49
CTDSP1 Q9GZU7 1/20 0.48
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C19 P33261 1/20 0.47

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
SCHEMBL8410033 0.89 HTT (0.58) HTTUSP2TSHRMAPTALOX15
SCHEMBL4258747 0.87 MAPT (0.59) HTTUSP2TSHRMAPTKMT2A
SCHEMBL4260903 0.86 HTT (0.77) HTTUSP2TSHRL3MBTL1PLK1
SCHEMBL4256238 0.85 HTT (0.72) HTTUSP2TSHRL3MBTL1PLK1
SCHEMBL6721454 0.85 HTT (0.75) HTTUSP2TSHRL3MBTL1PLK1
SCHEMBL10650463 0.85 HTT (0.75) HTTUSP2TSHRL3MBTL1PLK1
SCHEMBL10183478 0.85 HTT (0.75) HTTUSP2TSHRL3MBTL1PLK1
SCHEMBL13099992 0.84 HTT (0.73) HTTUSP2TSHRMAPTALOX15
SCHEMBL2627034 0.82 USP2 (0.70) HTTUSP2TSHRKMT2AALDH1A1
SCHEMBL2950041 0.81 HTT (0.61) HTTUSP2TSHRMAPTALOX15

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8207163-B2 Compositions, synthesis, and methods of using piperazine based antipsychotic agents REVIVA PHARMACEUTICALS, INC. (US) 2012-06-26 US disclosed
US-8207163-B2 Compositions, synthesis, and methods of using piperazine based antipsychotic agents REVIVA PHARMACEUTICALS, INC. (US) 2012-06-26 US disclosed
US-20090298819-A1 Compositions, Synthesis, And Methods Of Using Piperazine Based Antipsychotic Agents REVIVA PHARMACEUTICALS, INC. (US) 2009-12-03 US disclosed
US-20090298819-A1 Compositions, Synthesis, And Methods Of Using Piperazine Based Antipsychotic Agents REVIVA PHARMACEUTICALS, INC. (US) 2009-12-03 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-20090298819-A1 Compositions, Synthesis, And Methods Of Using Piperazine Based Antipsychotic Agents GRIK5, GAP43, GRIN2D HTT 1182/4885USP2 3572/4885TSHR 2113/4885

“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.