SCHEMBL17470097

SCHEMBL17470097

CCN1CCN(c2ccc(Nc3ncc(CCc4cc(C(=O)NC)cc(OC)c4F)cn3)cc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.50
▸ PTK2 Q05397 5/20 0.49
▸ FGFR3 P22607 4/20 0.46
▸ KCNH2 Q12809 2/20 0.43
▸ NTRK1 P04629 1/20 0.42
▸ KDR P35968 3/20 0.42
▸ LCK P06239 2/20 0.42
▸ MAPK14 Q16539 2/20 0.42
▸ ALK Q9UM73 2/20 0.42
▸ FGFR1 P11362 3/20 0.41
▸ FGFR4 P22455 3/20 0.41
▸ FGFR2 P21802 1/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ PKMYT1 Q99640 1/20 0.41
▸ STAT6 P42226 1/20 0.41
▸ WEE1 P30291 1/20 0.41

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
SCHEMBL17469965 0.93 POLB (0.49) POLBPTK2FGFR3KCNH2NTRK1
SCHEMBL17469949 0.91 POLB (0.51) POLBPTK2FGFR3KDRLCK
SCHEMBL17470189 0.91 BRD4 (0.48) POLBPTK2FGFR3KCNH2NTRK1
SCHEMBL16070344 0.91 FGFR3 (0.58) POLBPTK2FGFR3KCNH2KDR
SCHEMBL17470186 0.91 POLB (0.50) POLBPTK2FGFR3NTRK1KDR
SCHEMBL16069700 0.90 PKMYT1 (0.51) POLBPTK2FGFR3KCNH2KDR
SCHEMBL17469966 0.90 LRRK2 (0.47) PTK2FGFR3KCNH2NTRK1KDR
SCHEMBL17470015 0.88 FGFR3 (0.43) POLBPTK2FGFR3KCNH2KDR
SCHEMBL16070489 0.87 LRRK2 (0.42) PTK2FGFR3KCNH2NTRK1KDR
SCHEMBL17470090 0.85 FGFR3 (0.46) PTK2FGFR3KCNH2KDRLCK

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 POLB 1407/4885PTK2 1005/4885FGFR3 1/4885
US-20160024021-A1 NOVEL PYRIMIDINE AND PYRIDINE COMPOUNDS AND THEIR USAGE FGFR3, FGFR1, FGFR4 POLB 1260/4885PTK2 1034/4885FGFR3 1/4885

“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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