SCHEMBL4043337

SCHEMBL4043337

COC(=O)c1cccc2[nH]c(-c3n[nH]c4ncc(Br)cc34)nc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKN1 Q16512 3/20 0.52
PKN2 Q16513 3/20 0.52
CDK1 P06493 2/20 0.49
KDR P35968 2/20 0.49
RET P07949 2/20 0.48
FGFR1 P11362 1/20 0.45
CDK4 P11802 1/20 0.45
CCNA2 P20248 1/20 0.45
CCND1 P24385 1/20 0.45
CDK2 P24941 1/20 0.45
CCND3 P30281 1/20 0.45
RIPK1 Q13546 2/20 0.44
WNT1 P04628 1/20 0.41
TGFBR1 P36897 1/20 0.41
CLK2 P49760 1/20 0.41
CLK3 P49761 1/20 0.41
DYRK1A Q13627 1/20 0.41
PARP1 P09874 7/20 0.40
PLA2G2A P14555 1/20 0.39
ALOX15 P16050 1/20 0.39

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
SCHEMBL5821106 0.83 PKN1 (0.54) PKN1PKN2CDK1KDRRET
SCHEMBL4034227 0.82 RET (0.51) CDK1KDRRETFGFR1WNT1
SCHEMBL4036025 0.82 RET (0.70) CDK1KDRRETFGFR1WNT1
SCHEMBL4037517 0.81 CDK1 (0.75) PKN1PKN2CDK1KDRRET
SCHEMBL1170810 0.76 PKN1 (0.77) PKN1PKN2RIPK1CLK2DYRK1A
SCHEMBL4039789 0.75 RET (0.52) CDK1KDRRETWNT1TGFBR1
SCHEMBL4040032 0.75 RET (0.43) PKN2CDK1KDRRETFGFR1
SCHEMBL4043185 0.75 PDPK1 (0.67) PKN2CDK1KDRRETFGFR1
SCHEMBL22453146 0.75 PKN1 (0.75) PKN1PKN2PARP1PLA2G2AALOX15
SCHEMBL4040028 0.74 RET (0.55) CDK1KDRRETFGFR1WNT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7541367-B2 3-benzoimidazolyl-pyrazolopyridines useful in treating kinase disorders JANSSEN PHARMACEUTICA, N.V. (BE) 2009-06-02 US disclosed
US-20090048249-A1 3-benzoimidazolyl-pyrazolopyridines useful in treating kinase disorders JANSSEN PHARMACEUTICA, N.V. (BE) 2009-02-19 US disclosed
WO-2006130673-A1 3-BENZOIMIDAZOLYL-PYRAZOLOPYRIDINES USEFUL IN TREATING KINASE DISORDERS JANSSEN PHARMACEUTICA, N.V. (BE) 2006-12-07 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-20090048249-A1 3-benzoimidazolyl-pyrazolopyridines useful in treating kinase disorders PRKDC, PRKACA, ABL1 PKN1 135/4885PKN2 91/4885CDK1 307/4885

“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.