SCHEMBL16596184

SCHEMBL16596184

Cc1cc2cccc(Cl)c2c(=O)n1-c1cc(F)cc(F)c1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 12/20 0.45
PIK3R1 P27986 1/20 0.41
PIK3CG P48736 5/20 0.38
PIK3R2 O00459 2/20 0.38
MAPK14 Q16539 1/20 0.38
PIK3CA P42336 2/20 0.38
PIK3CB P42338 1/20 0.38
NOTUM Q6P988 1/20 0.37
KDM4E B2RXH2 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL16596152 0.92 PIK3CD (0.47) PIK3CDPIK3R1PIK3CGPIK3R2PIK3CA
SCHEMBL16596143 0.85 PIK3CD (0.48) PIK3CDPIK3R1PIK3CGPIK3R2PIK3CA
SCHEMBL16596822 0.85 CYP1A2 (0.41) PIK3CDPIK3R1PIK3CGMAPK14PIK3CA
SCHEMBL18885591 0.83 MAPK14 (0.46) PIK3CDPIK3CGPIK3R2MAPK14NOTUM
SCHEMBL22237967 0.83 ALDH1A1 (0.50) PIK3CDPIK3CGPIK3R2NOTUMKDM4E
SCHEMBL16591277 0.82 PIK3CD (0.41) PIK3CDPIK3R1PIK3CGPIK3CAPIK3CB
SCHEMBL14726573 0.80 PIK3CD (0.47) PIK3CDPIK3R1PIK3CGPIK3R2PIK3CA
SCHEMBL16596962 0.80 PIK3CD (0.55) PIK3CDPIK3R1PIK3CGPIK3R2PIK3CA
SCHEMBL16591302 0.78 PIK3CD (0.39) PIK3CDPIK3R1PIK3CGPIK3R2PIK3CA
SCHEMBL16596148 0.77 NOTUM (0.48) PIK3CDNOTUMKDM4ENPSR1

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-9657007-B2 Substituted aminopyrimidine compounds and methods of use CALITOR SCIENCES, LLC (US) 2017-05-23 US disclosed
US-20150087658-A1 SUBSTITUTED AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE CALITOR SCIENCES, LLC (US) 2015-03-26 US disclosed
WO-2015042078-A2 SUBSTITUTED AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE CALITOR SCIENCES, LLC (US) 2015-03-26 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-20150087658-A1 SUBSTITUTED AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE PIK3CA, PIK3CD, MYD88 PIK3CD 2/4885PIK3R1 9/4885PIK3CG 6/4885

“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.