SCHEMBL12440209

SCHEMBL12440209

Cc1ccc(F)c(-c2cc(-c3cncc(-c4cnn(C5CCN(C)CC5)c4)c3)c3cccnc3n2)c1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MET P08581 4/20 0.43
NTRK1 P04629 1/20 0.41
JAK2 O60674 1/20 0.39
JAK1 P23458 1/20 0.39
TYK2 P29597 1/20 0.39
JAK3 P52333 1/20 0.39
DYRK1A Q13627 8/20 0.39
WNT1 P04628 1/20 0.39
GSK3B P49841 6/20 0.38
EGFR P00533 3/20 0.37
PIM1 P11309 1/20 0.36
ACVR1 Q04771 2/20 0.36

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
SCHEMBL12439733 0.93 MET (0.46) METNTRK1JAK2JAK1TYK2
SCHEMBL12441209 0.93 MET (0.47) METNTRK1JAK2JAK1TYK2
SCHEMBL2323319 0.91 MET (0.43) METNTRK1JAK2JAK1TYK2
SCHEMBL2330194 0.90 MET (0.42) METNTRK1JAK2JAK1TYK2
SCHEMBL12441201 0.90 MET (0.42) METNTRK1JAK2JAK1TYK2
SCHEMBL12440751 0.90 FGFR1 (0.43) METACVR1
Formic Acid SCHEMBL13834691 0.88 MET (0.44) METNTRK1JAK2JAK1TYK2
SCHEMBL13835047 0.88 MET (0.43) METNTRK1JAK2JAK1TYK2
SCHEMBL12440266 0.88 MET (0.43) METNTRK1JAK2JAK1TYK2
SCHEMBL2325088 0.88 MET (0.43) METNTRK1JAK2JAK1TYK2

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-20120295902-A1 Hetaryl-[1,8]naphthyridine derivatives MERCK PATENT GMBH (DE) 2012-11-22 US disclosed
US-20120295902-A1 Hetaryl-[1,8]naphthyridine derivatives MERCK PATENT GMBH (DE) 2012-11-22 US disclosed
WO-2011095196-A1 HETARYL-[1,8]NAPHTHYRIDINE DERIVATIVES MERCK PATENT GMBH (DE) 2011-08-11 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-20120295902-A1 Hetaryl-[1,8]naphthyridine derivatives ATP5F1A, ATP5ME, ATP5F1D MET 2262/4885NTRK1 4085/4885JAK2 3649/4885

“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.