SCHEMBL8410033

SCHEMBL8410033

CCOC(=O)CCN1C(=O)COc2ccc(C(C)=O)cc21

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.58
USP2 O75604 1/20 0.58
MAPT P10636 2/20 0.53
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
KMO O15229 1/20 0.51
TSHR P16473 3/20 0.48
ALDH1A1 P00352 3/20 0.48
GAA P10253 1/20 0.48
ALOX15 P16050 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
POLB P06746 2/20 0.46
CYP1A2 P05177 2/20 0.46
CYP3A4 P08684 2/20 0.46
CYP2C19 P33261 2/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
MAPK1 P28482 1/20 0.46

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
SCHEMBL4258747 0.94 MAPT (0.59) HTTUSP2MAPTMEN1KMT2A
SCHEMBL4249933 0.89 HTT (0.73) HTTUSP2MAPTKMT2ATSHR
SCHEMBL8409946 0.86 HTT (0.57) HTTUSP2MAPTMEN1KMT2A
SCHEMBL1764005 0.80 MAPT (0.58) HTTMAPTKMOTSHRALDH1A1
SCHEMBL4256753 0.80 HTT (0.58) HTTUSP2MAPTMEN1KMT2A
SCHEMBL4250777 0.80 HTT (0.55) HTTUSP2MAPTMEN1KMT2A
SCHEMBL8264027 0.79 USP2 (0.57) HTTUSP2MAPTMEN1KMT2A
SCHEMBL1763825 0.78 MAPT (0.56) HTTUSP2MAPTKMOTSHR
SCHEMBL4258732 0.77 USP2 (0.53) HTTUSP2MAPTMEN1KMT2A
SCHEMBL16897914 0.77 TSHR (0.69) HTTMEN1KMT2ATSHRALDH1A1

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-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

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 3572/4885MAPT 692/4885

“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.