SCHEMBL15082385

SCHEMBL15082385

O=C(O)CCN1CC(C(=O)O)CC1=O

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.58
SMN1; SMN2 Q16637 2/20 0.56
HTT P42858 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.49
MAPT P10636 1/20 0.47
ALDH1A1 P00352 1/20 0.47
HPGD P15428 2/20 0.45
GAA P10253 1/20 0.44
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
RECQL P46063 1/20 0.41

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
SCHEMBL15082386 0.90 POLB (0.55) POLBSMN1; SMN2HTTL3MBTL1MAPT
SCHEMBL1538426 0.89 POLB (0.66) POLBSMN1; SMN2HTTL3MBTL1MAPT
SCHEMBL7951946 0.89 POLB (0.66) POLBSMN1; SMN2HTTL3MBTL1MAPT
SCHEMBL29367479 0.87 POLB (0.53) POLBSMN1; SMN2HTTL3MBTL1MAPT
SCHEMBL10922468 0.84 POLB (0.60) POLBSMN1; SMN2HTTL3MBTL1MAPT
SCHEMBL15082395 0.84 POLB (0.60) POLBSMN1; SMN2HTTL3MBTL1MAPT
SCHEMBL31537602 0.84 POLB (0.60) POLBSMN1; SMN2HTTL3MBTL1MAPT
SCHEMBL31537583 0.84 POLB (0.60) POLBSMN1; SMN2HTTL3MBTL1MAPT
SCHEMBL15041969 0.82 BRD4 (0.59) POLBSMN1; SMN2L3MBTL1ALDH1A1HPGD
SCHEMBL338776 0.82 POLB (0.58) POLBSMN1; SMN2HTTL3MBTL1MAPT

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-8585779-B2 Composition comprising at least one 2-pyrrolidone functionalized in the 4 position with a carboxylic acid or amide, and at least one direct dye or a pigment for dyeing keratin fibres L'OREAL (FR) 2013-11-19 US disclosed
US-20130167307-A1 COMPOSITION COMPRISING AT LEAST ONE 2-PYRROLIDONE FUNCTIONALIZED IN THE 4 POSITION WITH A CARBOXYLIC ACID OR AMIDE, AND AT LEAST ONE DIRECT DYE OR A PIGMENT FOR DYEING KERATIN FIBRES L'OREAL (FR) 2013-07-04 US disclosed
US-20130167307-A1 COMPOSITION COMPRISING AT LEAST ONE 2-PYRROLIDONE FUNCTIONALIZED IN THE 4 POSITION WITH A CARBOXYLIC ACID OR AMIDE, AND AT LEAST ONE DIRECT DYE OR A PIGMENT FOR DYEING KERATIN FIBRES L'OREAL (FR) 2013-07-04 US disclosed
WO-2011154460-A1 COMPOSITION COMPRISING AT LEAST ONE 2-PYRROLIDONE FUNCTIONALIZED IN THE 4 POSITION WITH A CARBOXYLIC ACID OR AMIDE, AND AT LEAST ONE DIRECT DYE OR A PIGMENT FOR DYEING KERATIN FIBRES L'OREAL (FR) 2011-12-15 WO 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-20130167307-A1 COMPOSITION COMPRISING AT LEAST ONE 2-PYRROLIDONE FUNCTIONALIZED IN THE 4 POSITION WITH A CARBOXYLIC ACID OR AMIDE, AND AT LEAST ONE DIRECT DYE OR A PIGMENT FOR DYEING KERATIN FIBRES KRT18, ADH1A, ADH1C POLB 648/4885SMN1; SMN2 4384/4885HTT 500/4885

“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.