SCHEMBL16070511

SCHEMBL16070511

CCN(CC)CCOc1ccc(Nc2ncc(OCc3cc(C(=O)NC)cc(OC)c3F)cn2)cc1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 1/20 0.44
▸ BCR P11274 1/20 0.44
▸ MCHR1 Q99705 1/20 0.43
▸ RIPK2 O43353 5/20 0.42
▸ NOD2 Q9HC29 5/20 0.42
▸ ACVR1 Q04771 4/20 0.42
▸ KDR P35968 3/20 0.41
▸ CDK4 P11802 5/20 0.41
▸ CCND1 P24385 5/20 0.41
▸ CCND2 P30279 5/20 0.41
▸ CCND3 P30281 5/20 0.41
▸ WEE1 P30291 2/20 0.40
▸ ESR1 P03372 1/20 0.40
▸ HRH3 Q9Y5N1 1/20 0.40
▸ PTK2 Q05397 1/20 0.39
▸ SRC P12931 1/20 0.39
▸ LCK P06239 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 0.86 PTK2 (0.44) KDRPTK2
SCHEMBL16070248 0.85 FGFR1 (0.38) PTK2SRC
SCHEMBL17469985 0.84 PTK2 (0.45) KDRPTK2
SCHEMBL16070250 0.84 PTK2 (0.45) KDRPTK2
SCHEMBL16069790 0.84 PTK2 (0.42) KDRPTK2
SCHEMBL16070358 0.83 FGFR3 (0.47) PTK2
SCHEMBL16070213 0.83 PTK2 (0.40) KDRPTK2
SCHEMBL16069763 0.83 FGFR3 (0.55) —
SCHEMBL16070209 0.82 FGFR3 (0.41) KDRPTK2
SCHEMBL16069930 0.82 PTK2 (0.42) KDRPTK2

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 ABL1 59/4885BCR 303/4885MCHR1 3492/4885

“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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