SCHEMBL754222

SCHEMBL754222

Clc1cn2nc(-c3cncnc3)ccc2n1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 2/20 0.45
PIK3CG P48736 1/20 0.41
AHR P35869 2/20 0.35
KDM4E B2RXH2 1/20 0.34
HSD17B10 Q99714 1/20 0.34
PDE10A Q9Y233 3/20 0.34
PIK3CA P42336 2/20 0.33
AKT1 P31749 1/20 0.33
MTOR P42345 1/20 0.33
ATM Q13315 1/20 0.33
CSNK1D P48730 1/20 0.33
CSNK1E P49674 1/20 0.33

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
SCHEMBL11043630 0.81 DYRK1A (0.45) DYRK1APIK3CGPDE10APIK3CAAKT1
SCHEMBL756100 0.73 KDM4E (0.50) DYRK1AAHRKDM4EPDE10A
SCHEMBL12664450 0.70 PIK3CG (0.49) PIK3CGPIK3CACSNK1DCSNK1E
SCHEMBL10277867 0.69 CSNK1D (0.40) AHRCSNK1DCSNK1E
SCHEMBL3086869 0.68 KDM4E (0.44) DYRK1AAHRKDM4EPDE10A
SCHEMBL2066344 0.68 PDE10A (0.36) DYRK1AAHRKDM4EPDE10A
SCHEMBL2066150 0.67 RBP4 (0.44) DYRK1AAHRKDM4EPDE10A
SCHEMBL3086598 0.66 AHR (0.39) DYRK1AAHRKDM4EPDE10A
SCHEMBL12909569 0.66 PIK3CG (0.59) DYRK1APIK3CGPIK3CAMTOR
SCHEMBL2065115 0.66 PDE10A (0.37) DYRK1AAHRPDE10A

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 DYRK1A 1062/4885PIK3CG 7/4885AHR 2362/4885

“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.