SCHEMBL2772205

SCHEMBL2772205

Cc1nc(N)cc(-c2c(Nc3ccc(N4CCN(C)CC4)cc3)nc3cccnn23)n1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 10/20 0.59
MTOR P42345 10/20 0.59
ADRA2A P08913 3/20 0.46
ADRA2B P18089 3/20 0.46
ADRA2C P18825 3/20 0.46
CDK4 P11802 2/20 0.41
KDR P35968 2/20 0.41
KDM1A O60341 3/20 0.41
GLA P06280 1/20 0.41
SLC2A1 P11166 1/20 0.41
RECQL P46063 1/20 0.41
BLM P54132 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
MAPKAPK2 P49137 1/20 0.41
CDK2 P24941 1/20 0.41
GSK3B P49841 1/20 0.41
BRD4 O60885 2/20 0.40

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
SCHEMBL2770089 0.91 PIK3CA (0.58) PIK3CAMTORADRA2CCDK4KDR
SCHEMBL11029742 0.86 PIK3CA (0.70) PIK3CAMTOR
SCHEMBL754291 0.85 PIK3CA (0.55) PIK3CAMTOR
SCHEMBL11029646 0.80 PIK3CA (0.68) PIK3CAMTOR
SCHEMBL2770778 0.79 PIK3CA (0.67) PIK3CAMTORCDK2
SCHEMBL751191 0.79 PIK3CA (0.57) PIK3CAMTOR
SCHEMBL751744 0.79 PIK3CA (0.57) PIK3CAMTORGLA
SCHEMBL751462 0.79 PIK3CA (0.54) PIK3CAMTORBLM
SCHEMBL753756 0.79 PIK3CA (0.56) PIK3CAMTORGLA
SCHEMBL754099 0.79 PIK3CA (0.66) PIK3CAMTOR

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 claimed
US-20120190666-A1 Heteroaryl Compounds as PIKK Inhibitors AMGEN INC. (US) 2012-07-26 US claimed
WO-2010132598-A1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS AMGEN INC. (US) 2010-11-18 WO claimed
EP-2430013-B1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS AMGEN INC (US) 2014-10-15 EP 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 PIK3CA 1/4885MTOR 21/4885ADRA2A 4011/4885

“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.