SCHEMBL4773311

SCHEMBL4773311

COC(=O)CCCNC(=O)c1ccc(N(Cc2cccc(Cl)c2Cl)S(C)(=O)=O)cc1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.48
MAPT P10636 1/20 0.46
ALDH1A1 P00352 4/20 0.46
NPSR1 Q6W5P4 4/20 0.45
HPGD P15428 1/20 0.44
KMT2A Q03164 3/20 0.43
LMNA P02545 3/20 0.43
MEN1 O00255 1/20 0.43
HDAC6 Q9UBN7 2/20 0.43
RECQL P46063 1/20 0.42
TP53 P04637 1/20 0.41
PKM P14618 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
SCHEMBL4773306 0.90 GAA (0.52) GAASMN1; SMN2MAPTALDH1A1NPSR1
SCHEMBL4777522 0.89 GAA (0.52) GAASMN1; SMN2MAPTALDH1A1NPSR1
SCHEMBL4767729 0.89 GAA (0.52) GAASMN1; SMN2MAPTALDH1A1NPSR1
SCHEMBL4769617 0.89 GAA (0.51) GAASMN1; SMN2MAPTALDH1A1NPSR1
SCHEMBL4774790 0.88 GAA (0.54) GAASMN1; SMN2MAPTALDH1A1NPSR1
SCHEMBL4773266 0.88 GAA (0.54) GAASMN1; SMN2MAPTALDH1A1NPSR1
SCHEMBL4835531 0.88 GAA (0.54) GAASMN1; SMN2MAPTALDH1A1NPSR1
SCHEMBL4777429 0.87 GAA (0.53) GAASMN1; SMN2MAPTALDH1A1NPSR1
SCHEMBL4776824 0.87 GAA (0.53) GAASMN1; SMN2MAPTALDH1A1NPSR1
SCHEMBL4773560 0.87 GAA (0.53) GAASMN1; SMN2MAPTALDH1A1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1942888-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS Cytokinetics, Inc. (US) 2008-07-16 EP claimed
US-20070135435-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INCORPORATED 2007-06-14 US claimed
WO-2007056078-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS CYTOKINETICS, INC. (US) 2007-05-18 WO claimed
EP-1942888-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS Cytokinetics, Inc. (US) 2008-07-16 EP disclosed
US-20070135435-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INCORPORATED 2007-06-14 US disclosed
WO-2007056078-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS CYTOKINETICS, INC. (US) 2007-05-18 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-20070135435-A1 Certain chemical entities, compositions, and methods KIF5B, KIF2C, PLK1 GAA 466/4885SMN1; SMN2 1149/4885MAPT 294/4885

“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.