SCHEMBL13655413

SCHEMBL13655413

COS(=O)(=O)N1CCN(Cc2cc(F)cc(NC(=O)Nc3ccc(C)nc3)c2)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 3/20 0.41
PIK3CD O00329 1/20 0.41
PIK3R1 P27986 1/20 0.41
PIK3CB P42338 1/20 0.41
PIK3CG P48736 1/20 0.41
KDM4E B2RXH2 5/20 0.40
ALDH1A1 P00352 4/20 0.40
HTT P42858 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
CYP1A2 P05177 1/20 0.39
GPR6 P46095 1/20 0.39
PLK4 O00444 1/20 0.38
PAK4 O96013 1/20 0.38
NTRK1 P04629 1/20 0.38
TBK1 Q9UHD2 1/20 0.38
NAMPT P43490 1/20 0.38
WNT1 P04628 1/20 0.38
CLK2 P49760 1/20 0.38
CLK3 P49761 1/20 0.38

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
SCHEMBL18827056 0.90 PIK3CA (0.44) PIK3CAPIK3CDPIK3R1PIK3CBPIK3CG
SCHEMBL399020 0.90 PIK3CA (0.50) PIK3CAPIK3CDPIK3R1PIK3CBPIK3CG
SCHEMBL402023 0.90 KDM4E (0.43) PIK3CAPIK3CDPIK3R1PIK3CBPIK3CG
SCHEMBL545389 0.87 PIK3CA (0.41) PIK3CAPIK3CDPIK3R1PIK3CBPIK3CG
SCHEMBL401393 0.87 CYP1A2 (0.48) PIK3CAPIK3CDPIK3R1PIK3CBPIK3CG
SCHEMBL401130 0.86 KDM4E (0.46) PIK3CAPIK3CDPIK3R1PIK3CBPIK3CG
SCHEMBL400684 0.86 PIK3CA (0.44) PIK3CAPIK3CDPIK3CBPIK3CGGPR6
SCHEMBL402649 0.86 PLK4 (0.49) MAPTPLK4PAK4NTRK1TBK1
SCHEMBL402839 0.85 WNT1 (0.48) KDM4EALDH1A1MAPTWNT1CLK2
SCHEMBL3209186 0.84 FAAH (0.44) PLK4PAK4NTRK1TBK1WNT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8871768-B2 Certain chemical entities, compositions and methods CYTOKINETICS, INC. (US) 2014-10-28 US disclosed
US-20090247544-A1 Certain Chemical Entities, Compositions and Methods CYTOKINETICS, INC. 2009-10-01 US disclosed
US-20090247544-A1 Certain Chemical Entities, Compositions and Methods CYTOKINETICS, INC. 2009-10-01 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-20090247544-A1 Certain Chemical Entities, Compositions and Methods TNNC1, TNNI3, TNNT2 PIK3CA 2144/4885PIK3CD 2476/4885PIK3R1 2473/4885

“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.