SCHEMBL1265628

SCHEMBL1265628

NCc1cc(-c2cccnc2Cl)ncn1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.39
CLK4 Q9HAZ1 3/20 0.38
CDC7 O00311 1/20 0.38
DAPK3 O43293 1/20 0.38
MAP4K4 O95819 1/20 0.38
PIM1 P11309 1/20 0.38
PRKACA P17612 1/20 0.38
FLT3 P36888 1/20 0.38
CDK8 P49336 1/20 0.38
CLK2 P49760 1/20 0.38
GSK3B P49841 1/20 0.38
CDK7 P50613 1/20 0.38
CDK9 P50750 1/20 0.38
PRKX P51817 1/20 0.38
CDK5 Q00535 1/20 0.38
DYRK1A Q13627 1/20 0.38
PKN2 Q16513 1/20 0.38
MINK1 Q8N4C8 1/20 0.38
HIPK2 Q9H2X6 1/20 0.38
STK17A Q9UEE5 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
SCHEMBL1265477 0.78 CDC7 (0.56) CLK4CDC7DAPK3MAP4K4PIM1
SCHEMBL580292 0.76 CTSA (0.40) DPP4CDC7MAP4K4NPC1RAB9A
SCHEMBL10271915 0.76 CLK4 (0.40) CLK4CDC7DAPK3MAP4K4PIM1
SCHEMBL24623012 0.72 PIP4K2A (0.43) CLK4CDC7DAPK3MAP4K4PIM1
SCHEMBL1265630 0.72 CYP1A2 (0.60) CLK4CDC7DAPK3MAP4K4PIM1
SCHEMBL16964533 0.71 CYP1A2 (0.57) DPP4CLK4CYP1A2CYP3A4KDM4E
SCHEMBL1265327 0.70 DPP4 (0.40) DPP4CDC7CDK9CDK5NPC1
SCHEMBL581004 0.70 DPP4 (0.40) DPP4NPC1RAB9AMEN1KMT2A
SCHEMBL1509639 0.69 ASIC3 (0.58) DPP4CLK4NPC1RAB9AKMT2A
SCHEMBL581150 0.69 MAPK10 (0.46) CLK4MAP4K4PRKACAFLT3GSK3B

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
US-20110201602-A1 PROTEIN KINASE MODULATORS AND METHOD OF USE AMGEN INC. (US) 2011-08-18 US disclosed
US-7880000-B2 N-(5-(1,1- dimethylethyl)-3- isoxazolyl)-4-methyl-3- ((3-(4-pyrimidinyl)-2- pyridinyl)amino)benzamide, used for treating breast cancer or rheumatoid arthritis AMGEN INC. (US) 2011-02-01 US disclosed
EP-1751136-A2 NITROGENATED HETEROCYCLIC DERIVATIVES AS PROTEIN KINASE MODULATORS AND USE FOR THE TREATMENT OF ANGIOGENESIS AND CANCER AMGEN INC. (US) 2007-02-14 EP disclosed
WO-2005113494-A2 NITROGENATED HETEROCYCLIC DERIVATIVES AS PROTEIN KINASE MODULATORS AND USE FOR THE TREATMENT OF ANGIOGENESIS AND CANCER AMGEN INC. (US) 2005-12-01 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-20110201602-A1 PROTEIN KINASE MODULATORS AND METHOD OF USE GRK4, MAP4K5, GRK5 DPP4 2776/4885CLK4 451/4885CDC7 255/4885

“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.