SCHEMBL16070504

SCHEMBL16070504

CNC(=O)c1cc(COc2cnc(Nc3ccc(C4CCNCC4)cc3)nc2)c(F)c(OC)c1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PTK2 Q05397 6/20 0.43
▸ JAK2 O60674 2/20 0.43
▸ JAK3 P52333 2/20 0.43
▸ FGFR1 P11362 1/20 0.41
▸ FGFR4 P22455 1/20 0.41
▸ KDR P35968 1/20 0.41
▸ FGFR3 P22607 7/20 0.41
▸ KCNH2 Q12809 4/20 0.41
▸ FLT4 P35916 1/20 0.39
▸ CSF1R P07333 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
SCHEMBL16070242 0.91 FGFR3 (0.42) PTK2FGFR1FGFR4KDRFGFR3
SCHEMBL16070260 0.91 FGFR3 (0.42) PTK2JAK2JAK3FGFR1FGFR4
SCHEMBL17469970 0.88 FGFR1 (0.44) PTK2JAK2JAK3FGFR1FGFR4
SCHEMBL16070223 0.86 FGFR3 (0.41) PTK2FGFR1FGFR4FGFR3KCNH2
SCHEMBL16070186 0.85 FGFR3 (0.46) PTK2FGFR1KDRFGFR3KCNH2
SCHEMBL16069792 0.85 PTK2 (0.44) PTK2JAK2JAK3FGFR1FGFR4
SCHEMBL17469985 0.84 PTK2 (0.45) PTK2JAK2JAK3FGFR1FGFR4
SCHEMBL16070250 0.84 PTK2 (0.45) PTK2JAK2JAK3FGFR1FGFR4
SCHEMBL16070358 0.83 FGFR3 (0.47) PTK2FGFR1FGFR4FGFR3KCNH2
SCHEMBL16070256 0.83 FGFR3 (0.57) JAK2JAK3FGFR1FGFR4KDR

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-9701680-B2 Pyrimidine and pyridine compounds and their usage HUTCHISON MEDIPHARMA LIMITED (CN) 2017-07-11 — — US disclosed
US-20160024021-A1 NOVEL PYRIMIDINE AND PYRIDINE COMPOUNDS AND THEIR USAGE HUTCHISON MEDIPHARMA LIMITED (CN) 2016-01-28 — — US disclosed
WO-2014139465-A1 NOVEL PYRIMIDINE AND PYRIDINE COMPOUNDS AND THEIR USAGE HUTCHISON MEDIPHARMA LIMITED (CN) 2014-09-18 — — 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-20160024021-A1 NOVEL PYRIMIDINE AND PYRIDINE COMPOUNDS AND THEIR USAGE FGFR3, FGFR1, FGFR4 PTK2 1034/4885JAK2 12/4885JAK3 39/4885

“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.

Send feedback