SCHEMBL4776872

SCHEMBL4776872

CS(=O)(=O)N(Cc1cccc(F)c1F)c1ccc(N(C=O)Cc2ccc(C(F)(F)F)nc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.39
LMNA P02545 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
HTT P42858 2/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPK1 P28482 1/20 0.34
HDAC6 Q9UBN7 3/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC5 Q9UQL6 1/20 0.33
RIPK1 Q13546 1/20 0.33
NR1H2 P55055 4/20 0.33
NR1H3 Q13133 4/20 0.33
GRM2 Q14416 1/20 0.31
KCNH2 Q12809 1/20 0.31
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31
POLB P06746 1/20 0.31

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
SCHEMBL4776637 0.92 RECQL (0.36) RECQLLMNASMN1; SMN2ALDH1A1HDAC6
SCHEMBL4768261 0.87 TRPM8 (0.38) RECQLALDH1A1HDAC6GRM2KCNH2
SCHEMBL4771247 0.87 ALDH1A1 (0.42) RECQLLMNASMN1; SMN2ALDH1A1HDAC6
SCHEMBL4772997 0.86 TRPM8 (0.39) SMN1; SMN2ALDH1A1HDAC6HDAC1HDAC5
SCHEMBL4772347 0.86 GAA (0.37) RECQLLMNAHDAC6HDAC1HDAC5
SCHEMBL5571164 0.86 GAA (0.44) LMNASMN1; SMN2HTTALDH1A1HDAC6
SCHEMBL4773365 0.86 LMNA (0.36) RECQLLMNASMN1; SMN2ALDH1A1HDAC6
SCHEMBL4772420 0.85 GAA (0.37) RECQLLMNAHDAC6HDAC1HDAC5
SCHEMBL4770843 0.85 LMNA (0.36) RECQLLMNAALDH1A1HDAC6HDAC1
SCHEMBL4776552 0.85 POLB (0.39) LMNAHTTALDH1A1HDAC6HDAC1

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
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
US-20070135435-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INCORPORATED 2007-06-14 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 (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 139/4885LMNA 1022/4885SMN1; SMN2 1149/4885

“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.