SCHEMBL10176243

SCHEMBL10176243

Nc1cccc(-c2cnc3cc(-c4cnn(C5CCN(C(=O)CCC6CC6)CC5)c4)cnn23)c1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDR P35968 7/20 0.46
MAP3K7 O43318 1/20 0.44
TAB1 Q15750 1/20 0.44
FGFR3 P22607 10/20 0.43
FGFR1 P11362 1/20 0.42
MET P08581 7/20 0.42
FYN P06241 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
SCHEMBL10177429 0.92 FGFR3 (0.47) KDRMAP3K7TAB1FGFR3FGFR1
SCHEMBL10177430 0.90 MAP3K7 (0.46) KDRMAP3K7TAB1FGFR3FGFR1
SCHEMBL10176246 0.89 FGFR3 (0.51) KDRMAP3K7TAB1FGFR3FGFR1
SCHEMBL10176110 0.87 MET (0.54) KDRMAP3K7TAB1FGFR3FGFR1
SCHEMBL10177301 0.84 MAP3K7 (0.46) KDRMAP3K7TAB1FGFR3FGFR1
SCHEMBL10176578 0.84 MAP3K7 (0.46) KDRMAP3K7TAB1FGFR3FGFR1
SCHEMBL9950530 0.84 KDR (0.68) KDRFGFR3
SCHEMBL10176147 0.83 MAP3K7 (0.43) KDRMAP3K7TAB1FGFR3FGFR1
SCHEMBL10176117 0.83 MAP3K7 (0.46) KDRMAP3K7TAB1FGFR3FGFR1
SCHEMBL10176389 0.81 FYN (0.45) KDRMAP3K7TAB1FGFR3FGFR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120165305-A1 SUBSTITUTED IMIDAZOPYRIDAZINES AND BENZIMIDAZOLES AS INHIBITORS OF FGFR3 INCYTE CORPORATION 2012-06-28 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 (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-20120165305-A1 SUBSTITUTED IMIDAZOPYRIDAZINES AND BENZIMIDAZOLES AS INHIBITORS OF FGFR3 FGFR3, FGFR4, FGFR2 KDR 133/4885MAP3K7 717/4885TAB1 490/4885

“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.