SCHEMBL17470118

SCHEMBL17470118

CCN1CCC(n2cc(Nc3ncc(CCc4cc(C(=O)NC)cc(OC)c4F)cn3)cn2)CC1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ FLT4 P35916 2/20 0.45
▸ FGFR3 P22607 8/20 0.43
▸ FGFR1 P11362 2/20 0.42
▸ KCNH2 Q12809 3/20 0.42
▸ KDR P35968 2/20 0.42
▸ FGFR2 P21802 1/20 0.42
▸ FGFR4 P22455 1/20 0.42
▸ JAK3 P52333 7/20 0.41
▸ JAK2 O60674 4/20 0.41
▸ JAK1 P23458 3/20 0.41
▸ TYK2 P29597 1/20 0.40
▸ IGF1R P08069 1/20 0.40
▸ ROS1 P08922 1/20 0.37
▸ ALK Q9UM73 1/20 0.37

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
SCHEMBL17470088 0.95 FGFR3 (0.42) FLT4FGFR3FGFR1KCNH2KDR
SCHEMBL17469981 0.95 FGFR3 (0.42) FLT4FGFR3FGFR1KCNH2KDR
SCHEMBL17470190 0.93 JAK3 (0.45) FGFR3FGFR1KCNH2KDRFGFR2
SCHEMBL17469982 0.92 FGFR3 (0.49) FLT4FGFR3FGFR1KCNH2KDR
SCHEMBL17469963 0.92 FGFR3 (0.40) FLT4FGFR3FGFR1KCNH2KDR
SCHEMBL17469984 0.92 FLT4 (0.43) FLT4FGFR3FGFR1KDRFGFR2
SCHEMBL17470080 0.91 JAK3 (0.46) FGFR3FGFR1KCNH2KDRFGFR2
SCHEMBL16069698 0.91 JAK3 (0.46) FGFR3FGFR1KCNH2KDRFGFR2
SCHEMBL16069724 0.91 FGFR3 (0.40) FLT4FGFR3FGFR1KCNH2KDR
SCHEMBL17469983 0.91 FGFR3 (0.40) FLT4FGFR3FGFR1KCNH2KDR

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-20160052926-A1 NOVEL PYRIMIDINE AND PYRIDINE COMPOUNDS AND USAGE THEREOF HUTCHISON MEDIPHARMA LIMITED (CN) 2016-02-25 — — US disclosed
US-20160024021-A1 NOVEL PYRIMIDINE AND PYRIDINE COMPOUNDS AND THEIR USAGE HUTCHISON MEDIPHARMA LIMITED (CN) 2016-01-28 — — 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 (2 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-20160052926-A1 NOVEL PYRIMIDINE AND PYRIDINE COMPOUNDS AND USAGE THEREOF FGFR3, FGFR1, FGFR4 FLT4 34/4885FGFR3 1/4885FGFR1 2/4885
US-20160024021-A1 NOVEL PYRIMIDINE AND PYRIDINE COMPOUNDS AND THEIR USAGE FGFR3, FGFR1, FGFR4 FLT4 36/4885FGFR3 1/4885FGFR1 2/4885

“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.

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