SCHEMBL10177429

SCHEMBL10177429

Nc1cccc(-c2cnc3cc(-c4cnn(C5CCN(C(=O)CC6CC6)CC5)c4)cnn23)c1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FGFR3 P22607 5/20 0.47
MAP3K7 O43318 1/20 0.45
TAB1 Q15750 1/20 0.45
KDR P35968 3/20 0.45
MET P08581 10/20 0.45
FGFR1 P11362 1/20 0.43
FYN P06241 1/20 0.40
MAP4K3 Q8IVH8 1/20 0.39
DYRK3 O43781 1/20 0.38
CCNT1 O60563 1/20 0.38
CCNA2 P20248 1/20 0.38
CDK2 P24941 1/20 0.38
CDK9 P50750 1/20 0.38
CDK5 Q00535 1/20 0.38
DYRK1A Q13627 1/20 0.38
CDK5R1 Q15078 1/20 0.38
DYRK2 Q92630 1/20 0.38
DYRK1B Q9Y463 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
SCHEMBL10176246 0.97 FGFR3 (0.51) FGFR3MAP3K7TAB1KDRMET
SCHEMBL10176243 0.92 KDR (0.46) FGFR3MAP3K7TAB1KDRMET
SCHEMBL10177430 0.91 MAP3K7 (0.46) FGFR3MAP3K7TAB1KDRMET
SCHEMBL10176110 0.88 MET (0.54) FGFR3MAP3K7TAB1KDRMET
SCHEMBL10176147 0.88 MAP3K7 (0.43) FGFR3MAP3K7TAB1KDRMET
SCHEMBL10177301 0.85 MAP3K7 (0.46) FGFR3MAP3K7TAB1KDRMET
SCHEMBL10176578 0.85 MAP3K7 (0.46) FGFR3MAP3K7TAB1KDRMET
SCHEMBL10176117 0.84 MAP3K7 (0.46) FGFR3MAP3K7TAB1KDRMET
SCHEMBL10176389 0.83 FYN (0.45) FGFR3MAP3K7TAB1KDRMET
SCHEMBL9949743 0.82 FGFR3 (0.71) FGFR3KDR

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 FGFR3 1/4885MAP3K7 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.