SCHEMBL4277490

SCHEMBL4277490

CNC(=O)c1ccc(-c2ccc[c]c2Cl)cc1O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.40
PAK1 Q13153 1/20 0.37
EGLN1 Q9GZT9 1/20 0.36
HSD17B3 P37058 1/20 0.36
HNF4A P41235 1/20 0.36
ACMSD Q8TDX5 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ALOX5AP P20292 1/20 0.35
FEN1 P39748 1/20 0.35
MCL1 Q07820 1/20 0.34
KDM4E B2RXH2 1/20 0.34
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34
CASP1 P29466 1/20 0.34
NUDT1 P36639 1/20 0.34
MPO P05164 1/20 0.33
HSD17B1 P14061 1/20 0.33
MTOR P42345 1/20 0.33
GAA P10253 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
SCHEMBL4280909 0.85 ALDH1A1 (0.41) HSD17B3HNF4AACMSDMEN1KMT2A
SCHEMBL4277908 0.84 PDK2 (0.49) PDK2KDM4ELMNAGAACYP1A2
SCHEMBL4282490 0.82 MKNK1 (0.47) PDK2HNF4AACMSDKMT2AMCL1
SCHEMBL4282096 0.81 MEN1 (0.41) PDK2HNF4AACMSDMEN1KMT2A
SCHEMBL20448911 0.76 GAA (0.47) CASP1GAAALDH1A1POLB
SCHEMBL4276945 0.75 APP (0.40) KMT2AMCL1KDM4ECASP1HSD17B1
SCHEMBL4276821 0.75 APP (0.42) MEN1KMT2AHTTAPPALDH1A1
SCHEMBL4280979 0.72 HSD17B1 (0.45) ACMSDHSD17B1APP
SCHEMBL3814303 0.71 P2RX1 (0.53) KDM4ELMNAHTTGAAALDH1A1
SCHEMBL4277811 0.70 PTGES2 (0.39) ALOX5APFEN1APP

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-2397462-A2 Compounds, compositions and methods of treatment for heart failure Cytokinetics, Inc. (US) 2011-12-21 EP disclosed
US-20090176307-A1 Compounds, Compositions and Methods CYTOKINETICS, INC. 2009-07-09 US disclosed
US-7491826-B2 Compounds, compositions and methods CYTOKINETICS, INC. (US) 2009-02-17 US disclosed
US-7399866-B2 Compounds, compositions, and methods CYTOKINETICS, INC. (US) 2008-07-15 US disclosed
US-20060241110-A1 Compounds, compositions, and methods CYTOKINETICS, INCORPORATED 2006-10-26 US disclosed
US-20050159416-A1 Compounds, compositions and methods CYTOKINETICS, INCORPORATED 2005-07-21 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 (2 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-20060241110-A1 Compounds, compositions, and methods TNNI3, TNNT2, TNNC1 PDK2 3935/4885PAK1 2516/4885EGLN1 2250/4885
US-20050159416-A1 Compounds, compositions and methods TNNI3, TNNC1, TNNT2 PDK2 3769/4885PAK1 2500/4885EGLN1 2264/4885

“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.