SCHEMBL17470138

SCHEMBL17470138

CNC(=O)c1cc(COc2ccc(Nc3ccc(N4C[C@@H](C)N[C@@H](C)C4)cc3)nc2)c(F)c(OC)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FGFR1 P11362 8/20 0.63
▸ CHRNB4 P30926 3/20 0.43
▸ CHRNA3 P32297 3/20 0.43
▸ NTRK1 P04629 1/20 0.42
▸ RET P07949 1/20 0.42
▸ PDGFRB P09619 1/20 0.42
▸ MARK3 P27448 1/20 0.42
▸ TNK2 Q07912 1/20 0.42
▸ DDR1 Q08345 1/20 0.42
▸ MAP4K2 Q12851 1/20 0.42
▸ MAP3K11 Q16584 1/20 0.42
▸ DDR2 Q16832 1/20 0.42
▸ MARK2 Q7KZI7 1/20 0.42
▸ MAP4K3 Q8IVH8 1/20 0.42
▸ MAP4K1 Q92918 1/20 0.42
▸ AURKB Q96GD4 1/20 0.42
▸ EIF2AK1 Q9BQI3 1/20 0.42
▸ MAP3K20 Q9NYL2 1/20 0.42
▸ STK26 Q9P289 1/20 0.42
▸ TNIK Q9UKE5 1/20 0.42

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
SCHEMBL17470095 0.91 FGFR1 (0.54) FGFR1NTRK1RETPDGFRBMARK3
SCHEMBL19101599 0.86 FGFR1 (0.47) FGFR1CHRNB4CHRNA3JAK1TYK2
SCHEMBL17537641 0.83 FGFR1 (0.53) FGFR1NTRK1RETPDGFRBMARK3
SCHEMBL16053170 0.82 FGFR1 (0.48) FGFR1NTRK1RETPDGFRBMARK3
SCHEMBL17470065 0.81 FGFR3 (0.52) FGFR1TNK2FGFR2BCL6WEE1
SCHEMBL16070226 0.81 FGFR3 (0.51) FGFR1CSF1RFGFR2BCL6SCN9A
SCHEMBL16050076 0.81 FGFR1 (0.49) FGFR1NTRK1RETPDGFRBMARK3
SCHEMBL17470200 0.81 FGFR3 (0.44) FGFR1FGFR2FGFR4FGFR3
SCHEMBL17470145 0.81 KCNH2 (0.51) FGFR1TNK2BCL6FGFR4FGFR3
SCHEMBL17470064 0.80 FGFR3 (0.52) FGFR1TNK2CSF1RBCL6FGFR4

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 FGFR1 2/4885CHRNB4 4085/4885CHRNA3 3874/4885
US-20160024021-A1 NOVEL PYRIMIDINE AND PYRIDINE COMPOUNDS AND THEIR USAGE FGFR3, FGFR1, FGFR4 FGFR1 2/4885CHRNB4 4090/4885CHRNA3 3860/4885

“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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