SCHEMBL4034227

SCHEMBL4034227

Cc1cccc2[nH]c(-c3n[nH]c4ncc(Br)cc34)nc12

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RET P07949 1/20 0.51
FGFR1 P11362 1/20 0.46
ADORA3 P0DMS8 1/20 0.44
ADORA2A P29274 1/20 0.44
ADORA1 P30542 1/20 0.44
ESR1 P03372 1/20 0.44
CBFB Q13951 1/20 0.44
WNT1 P04628 1/20 0.44
TGFBR1 P36897 1/20 0.44
PDPK1 O15530 1/20 0.44
MGAM O43451 12/20 0.43
GAA P10253 12/20 0.43
SI P14410 12/20 0.43
MGAM2 Q2M2H8 12/20 0.43
ERBB2 P04626 1/20 0.42
CDK1 P06493 1/20 0.42
KDR P35968 1/20 0.42

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
SCHEMBL4036025 0.86 RET (0.70) RETFGFR1WNT1TGFBR1PDPK1
SCHEMBL4043337 0.82 PKN1 (0.52) RETFGFR1WNT1TGFBR1PDPK1
SCHEMBL4039789 0.81 RET (0.52) RETWNT1TGFBR1PDPK1ERBB2
SCHEMBL4043185 0.81 PDPK1 (0.67) RETFGFR1WNT1TGFBR1PDPK1
SCHEMBL4040028 0.80 RET (0.55) RETFGFR1WNT1TGFBR1PDPK1
SCHEMBL4040032 0.79 RET (0.43) RETFGFR1WNT1TGFBR1PDPK1
SCHEMBL4042735 0.78 CDK1 (0.70) RETFGFR1WNT1TGFBR1ERBB2
SCHEMBL13558782 0.74 FGFR1 (0.58) FGFR1ESR1CBFBWNT1TGFBR1
SCHEMBL4037154 0.73 PDPK1 (0.51) RETFGFR1CBFBPDPK1ERBB2
SCHEMBL4036085 0.71 KDR (0.56) RETWNT1TGFBR1ERBB2CDK1

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 RET 222/4885FGFR1 508/4885ADORA3 4422/4885

“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.