SCHEMBL753748

SCHEMBL753748

Cc1nc(Cl)cc(-c2c(Cl)nc3ccc(-c4cncnc4)nn23)n1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.36
CLK2 P49760 1/20 0.33
DYRK1A Q13627 1/20 0.33
HASPIN Q8TF76 1/20 0.33
MET P08581 1/20 0.32
FYN P06241 1/20 0.31
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
PIK3CD O00329 1/20 0.30
PIK3CA P42336 1/20 0.30
PIK3CB P42338 1/20 0.30
PIK3CG P48736 1/20 0.30

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
SCHEMBL751865 0.88 PIK3CA (0.39) PDE10ACLK2DYRK1AHASPINMET
SCHEMBL28349005 0.76 PIM1 (0.36)
SCHEMBL754782 0.72 PIK3CA (0.47) PDE10APIK3CA
SCHEMBL750591 0.69 MTOR (0.54) PDE10APIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL752419 0.69 MTOR (0.47) PIK3CA
SCHEMBL751467 0.69 PIK3CA (0.45) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL753757 0.66 GAA (0.38) NPC1RAB9APIK3CDPIK3CA
SCHEMBL754222 0.64 DYRK1A (0.45) PDE10ADYRK1APIK3CAPIK3CG
SCHEMBL4054058 0.62 PIK3CA (0.61) FYNPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL10685624 0.60 GSK3B (0.46) PDE10ADYRK1ANPC1RAB9A

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-2430013-B1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS AMGEN INC (US) 2014-10-15 EP disclosed
US-20120190666-A1 Heteroaryl Compounds as PIKK Inhibitors AMGEN INC. (US) 2012-07-26 US disclosed
EP-2430013-A1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS Amgen, Inc (US) 2012-03-21 EP disclosed
WO-2010132598-A1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS AMGEN INC. (US) 2010-11-18 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-20120190666-A1 Heteroaryl Compounds as PIKK Inhibitors PIK3CA, PIKFYVE, PIK3CD PDE10A 2496/4885CLK2 320/4885DYRK1A 1062/4885

“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.