SCHEMBL4773331

SCHEMBL4773331

CS(=O)(=O)N(Cc1cccc(Cl)c1Cl)c1ccc(C(=O)NCCC2CCOCC2)cc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.50
GAA P10253 1/20 0.48
ALDH1A1 P00352 5/20 0.46
POLB P06746 2/20 0.46
NPSR1 Q6W5P4 2/20 0.45
NAMPT P43490 1/20 0.43
TGM2 P21980 1/20 0.43
KMT2A Q03164 3/20 0.43
LMNA P02545 2/20 0.42
MEN1 O00255 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MAPT P10636 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40

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
SCHEMBL4777321 0.84 ALDH1A1 (0.54) GAAALDH1A1POLBKMT2ALMNA
SCHEMBL4777302 0.83 GAA (0.56) RECQLGAAALDH1A1POLBNPSR1
SCHEMBL4776728 0.82 ALDH1A1 (0.50) RECQLGAAALDH1A1POLBNPSR1
SCHEMBL4777569 0.82 CA12 (0.51) GAAALDH1A1LMNASMN1; SMN2
SCHEMBL4777649 0.82 GAA (0.55) RECQLGAAALDH1A1POLBNPSR1
SCHEMBL4777484 0.82 GAA (0.46) RECQLGAAALDH1A1POLBNPSR1
SCHEMBL4773266 0.81 GAA (0.54) RECQLGAAALDH1A1POLBNPSR1
SCHEMBL4774790 0.81 GAA (0.54) RECQLGAAALDH1A1NPSR1KMT2A
SCHEMBL4776824 0.80 GAA (0.53) RECQLGAAALDH1A1POLBNPSR1
SCHEMBL4777429 0.80 GAA (0.53) RECQLGAAALDH1A1NPSR1KMT2A

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-20070135435-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INCORPORATED 2007-06-14 US 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 RECQL 139/4885GAA 466/4885ALDH1A1 2159/4885

“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.