SCHEMBL10176389

SCHEMBL10176389

Nc1cccc(-c2cnc3cc(-c4cnn(C5CCN(C(=O)C6CCOC6)CC5)c4)cnn23)c1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FYN P06241 1/20 0.45
MAP3K7 O43318 6/20 0.45
TAB1 Q15750 6/20 0.45
FGFR3 P22607 6/20 0.42
KDR P35968 3/20 0.42
FGFR1 P11362 4/20 0.42
MET P08581 4/20 0.39
PIK3CD O00329 1/20 0.38
NTRK1 P04629 1/20 0.38
PDGFRB P09619 1/20 0.38
KIT P10721 1/20 0.38
FLT3 P36888 1/20 0.38
GRM5 P41594 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
SCHEMBL10177430 0.84 MAP3K7 (0.46) FYNMAP3K7TAB1FGFR3KDR
SCHEMBL10177301 0.83 MAP3K7 (0.46) FYNMAP3K7TAB1FGFR3KDR
SCHEMBL10176578 0.83 MAP3K7 (0.46) FYNMAP3K7TAB1FGFR3KDR
SCHEMBL10177429 0.83 FGFR3 (0.47) FYNMAP3K7TAB1FGFR3KDR
SCHEMBL9949392 0.82 FGFR3 (0.67) FGFR3KDR
SCHEMBL10176117 0.82 MAP3K7 (0.46) FYNMAP3K7TAB1FGFR3KDR
SCHEMBL10176110 0.81 MET (0.54) MAP3K7TAB1FGFR3KDRFGFR1
SCHEMBL10176243 0.81 KDR (0.46) FYNMAP3K7TAB1FGFR3KDR
SCHEMBL10176246 0.81 FGFR3 (0.51) FYNMAP3K7TAB1FGFR3KDR
SCHEMBL10176147 0.81 MAP3K7 (0.43) FYNMAP3K7TAB1FGFR3KDR

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 FYN 53/4885MAP3K7 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.