SCHEMBL264977

SCHEMBL264977

Cc1c(N)nc(Nc2ccc(CN3CCNCC3)cc2)nc1-c1cccc2[nH]ccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 2/20 0.47
KDR P35968 2/20 0.47
PLK4 O00444 1/20 0.41
GAA P10253 1/20 0.41
PRKCQ Q04759 2/20 0.38
PRKCD Q05655 1/20 0.38
MAP3K11 Q16584 1/20 0.38
CXCR4 P61073 3/20 0.38
ABL1 P00519 1/20 0.37
SRC P12931 1/20 0.37
AXL P30530 3/20 0.37
MET P08581 2/20 0.37
MERTK Q12866 2/20 0.37
CCND1 P24385 1/20 0.37
CDK6 Q00534 1/20 0.37
PTK2 Q05397 1/20 0.37
DRD2 P14416 1/20 0.37
DRD4 P21917 1/20 0.37
DRD3 P35462 1/20 0.37
CSNK2A1 P68400 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
SCHEMBL265210 0.91 CDK1 (0.47) CDK1KDRPLK4GAAPRKCQ
SCHEMBL264978 0.85 PLK4 (0.41) CDK1KDRPLK4MAP3K11AXL
SCHEMBL265114 0.80 KDR (0.40) CDK1KDRPRKCDABL1SRC
SCHEMBL264405 0.79 TTK (0.52) CCND1PTK2CDK2
SCHEMBL264818 0.74 AXL (0.47) CDK1KDRAXLCDK2FLT3
SCHEMBL264164 0.72 BRD4 (0.45) PLK4AXLMETMERTK
SCHEMBL3970782 0.70 PLK4 (0.41) KDRPLK4MAP3K11CXCR4ABL1
SCHEMBL264622 0.68 ACP1 (0.46) CDK1KDRSRCAXLMET
SCHEMBL265022 0.67 BRD4 (0.38) AXLPIK3CA
SCHEMBL265978 0.66 AURKB (0.56) SRCAXLCDK6PTK2CDK2

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8604042-B2 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2013-12-10 US disclosed
US-8138199-B2 Use of bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2012-03-20 US disclosed
US-8133900-B2 Use of bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2012-03-13 US disclosed
US-20110212077-A1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES TARGEGEN, INC. (US) 2011-09-01 US disclosed
US-7825246-B2 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2010-11-02 US disclosed
US-20090286789-A1 Bi-Aryl Meta-Pyrimidine Inhibitors of Kinases TARGEGEN, INC. (US) 2009-11-19 US disclosed
US-20090275582-A1 Bi-Aryl Meta-Pyrimidine Inhibitors of Kinases IMPACT BIOMEDICINES, INC. 2009-11-05 US disclosed
US-7528143-B2 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2009-05-05 US disclosed
US-20070259904-A1 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2007-11-08 US disclosed
US-20070191405-A1 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2007-08-16 US 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 (5 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-20090286789-A1 Bi-Aryl Meta-Pyrimidine Inhibitors of Kinases JAK2, TYK2, LTK CDK1 358/4885KDR 684/4885PLK4 724/4885
US-20070191405-A1 Bi-aryl meta-pyrimidine inhibitors of kinases JAK2, TYK2, JAK3 CDK1 132/4885KDR 419/4885PLK4 440/4885
US-20070259904-A1 Bi-aryl meta-pyrimidine inhibitors of kinases JAK2, TYK2, JAK3 CDK1 132/4885KDR 419/4885PLK4 440/4885
US-20090275582-A1 Bi-Aryl Meta-Pyrimidine Inhibitors of Kinases JAK2, TYK2, JAK3 CDK1 132/4885KDR 419/4885PLK4 440/4885
US-20110212077-A1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES JAK2, TYK2, JAK3 CDK1 132/4885KDR 419/4885PLK4 440/4885

“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.