SCHEMBL4777632

SCHEMBL4777632

Cc1ccc(CN(C=O)c2ccc(N(Cc3ccccc3Cl)S(C)(=O)=O)cc2)o1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.41
ALDH1A1 P00352 6/20 0.41
HPGD P15428 2/20 0.41
MAPT P10636 2/20 0.38
TP53 P04637 2/20 0.37
RECQL P46063 3/20 0.36
KDM4E B2RXH2 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
POLB P06746 4/20 0.35
LMNA P02545 2/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
GFER P55789 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL4776713 0.84 GAA (0.46) GAAALDH1A1HPGDMAPTTP53
SCHEMBL4771109 0.78 GAA (0.41) GAAALDH1A1HPGDMAPTRECQL
SCHEMBL4777570 0.77 GAA (0.43) GAAALDH1A1HPGDMAPTPOLB
SCHEMBL4776386 0.74 CYP2A13 (0.46) GAAALDH1A1SMN1; SMN2LMNANPSR1
SCHEMBL4777339 0.73 GAA (0.56) GAAALDH1A1MAPTKDM4ESMN1; SMN2
SCHEMBL4776590 0.73 GAA (0.42) GAAALDH1A1HPGDMAPTRECQL
SCHEMBL4769719 0.73 POLB (0.43) GAAALDH1A1MAPTKDM4ESMN1; SMN2
SCHEMBL4777639 0.72 GAA (0.44) GAAALDH1A1HPGDMAPTTP53
SCHEMBL5571164 0.72 GAA (0.44) GAAALDH1A1MAPTSMN1; SMN2POLB
SCHEMBL4771377 0.72 GAA (0.40) GAAALDH1A1MAPTRECQLKDM4E

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 466/4885ALDH1A1 2159/4885HPGD 2681/4885

“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.