SCHEMBL1491176

SCHEMBL1491176

CCOC(=O)CCCOc1ccccc1N1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.51
GAA P10253 3/20 0.51
PKM P14618 1/20 0.49
L3MBTL1 Q9Y468 2/20 0.48
MAPT P10636 3/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
ALDH1A1 P00352 1/20 0.47
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
HTR1A P08908 1/20 0.46
HTR7 P34969 1/20 0.46
APAF1 O14727 1/20 0.46
LMNA P02545 1/20 0.46
TSHR P16473 2/20 0.45
CKS1B P61024 1/20 0.45
SKP1 P63208 1/20 0.45
SKP2 Q13309 1/20 0.45
USP2 O75604 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45

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
SCHEMBL3260753 1.00 SMN1; SMN2 (0.51) SMN1; SMN2GAAPKML3MBTL1MAPT
SCHEMBL8139472 0.88 SMN1; SMN2 (0.54) SMN1; SMN2GAAPKML3MBTL1MAPT
SCHEMBL1493568 0.87 PKM (0.53) SMN1; SMN2GAAPKML3MBTL1MAPT
SCHEMBL4253507 0.84 SMN1; SMN2 (0.50) SMN1; SMN2GAAPKML3MBTL1MAPT
SCHEMBL3404794 0.81 L3MBTL1 (0.59) SMN1; SMN2GAAL3MBTL1MAPTALDH1A1
SCHEMBL3157375 0.81 HTR1A (0.51) GAAPKML3MBTL1MAPTALDH1A1
SCHEMBL23855531 0.80 GAA (0.49) SMN1; SMN2GAAL3MBTL1ALDH1A1TSHR
SCHEMBL7334443 0.80 SMN1; SMN2 (0.56) SMN1; SMN2GAAPKML3MBTL1MAPT
SCHEMBL3157870 0.80 DRD2 (0.61) ALDH1A1MEN1KMT2AHTR1AHTR7
SCHEMBL1491191 0.79 SMN1; SMN2 (0.54) SMN1; SMN2GAAPKML3MBTL1MAPT

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
EP-2299814-A1 COMPOSITIONS, SYNTHESIS, AND METHODS OF USING PIPERAZINE BASED ANTIPSYCHOTIC AGENTS Reviva Pharmaceuticals, Inc. (US) 2011-03-30 EP disclosed
WO-2009154993-A1 COMPOSITIONS, SYNTHESIS, AND METHODS OF USING PIPERAZINE BASED ANTIPSYCHOTIC AGENTS REVIVA PHARMACEUTICALS, INC. (US) 2009-12-23 WO 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 SMN1; SMN2 3263/4885GAA 3519/4885PKM 2353/4885

“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.