SCHEMBL16069930

SCHEMBL16069930

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

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTK2 Q05397 7/20 0.42
▸ FGFR3 P22607 4/20 0.40
▸ PDE4B Q07343 4/20 0.40
▸ FGFR1 P11362 2/20 0.40
▸ FGFR4 P22455 2/20 0.40
▸ NR1H4 Q96RI1 2/20 0.40
▸ FGFR2 P21802 1/20 0.40
▸ PDE4D Q08499 3/20 0.39
▸ JAK2 O60674 1/20 0.39
▸ NTRK1 P04629 1/20 0.39
▸ TYK2 P29597 1/20 0.39
▸ KDR P35968 1/20 0.39
▸ JAK3 P52333 1/20 0.39
▸ PTK2B Q14289 1/20 0.39
▸ NTRK3 Q16288 1/20 0.39
▸ NTRK2 Q16620 1/20 0.39
▸ HDAC3 O15379 1/20 0.39
▸ HDAC1 Q13547 1/20 0.39
▸ HDAC2 Q92769 1/20 0.39
▸ HDAC6 Q9UBN7 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
SCHEMBL16069792 0.90 PTK2 (0.44) PTK2FGFR3FGFR1FGFR4FGFR2
SCHEMBL16069691 0.88 FGFR3 (0.42) PTK2FGFR3PDE4BFGFR1FGFR4
SCHEMBL16070250 0.88 PTK2 (0.45) PTK2FGFR3FGFR1FGFR4FGFR2
SCHEMBL17469985 0.88 PTK2 (0.45) PTK2FGFR3FGFR1FGFR4FGFR2
SCHEMBL16070358 0.87 FGFR3 (0.47) PTK2FGFR3FGFR1FGFR4FGFR2
SCHEMBL16070213 0.87 PTK2 (0.40) PTK2FGFR3FGFR1FGFR4FGFR2
SCHEMBL16070506 0.86 FGFR3 (0.42) PTK2FGFR3FGFR1FGFR4FGFR2
SCHEMBL16069790 0.86 PTK2 (0.42) PTK2FGFR3FGFR1FGFR4FGFR2
SCHEMBL16070209 0.84 FGFR3 (0.41) PTK2FGFR3FGFR1FGFR4FGFR2
SCHEMBL16070230 0.84 ULK1 (0.48) PTK2FGFR3FGFR1FGFR4FGFR2

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 5 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
WO-2014139145-A1 NOVEL PYRIMIDINE AND PYRIDINE COMPOUNDS AND USAGE THEREOF HUTCHISON MEDIPHARMA LIMITED (CN) 2014-09-18 — — WO 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 (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 PTK2 1005/4885FGFR3 1/4885PDE4B 1081/4885
US-20160024021-A1 NOVEL PYRIMIDINE AND PYRIDINE COMPOUNDS AND THEIR USAGE FGFR3, FGFR1, FGFR4 PTK2 1034/4885FGFR3 1/4885PDE4B 1167/4885

“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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