SCHEMBL12426286

SCHEMBL12426286

CC(C)(N)C(=O)Nc1cc(Nc2cc(-c3cc(Cl)ccc3F)nc3ncccc23)ncn1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 1/20 0.39
EGFR P00533 1/20 0.37
ERBB3 P21860 1/20 0.37
TGFBR1 P36897 13/20 0.36
ACVRL1 P37023 6/20 0.35
ACVR1B P36896 6/20 0.35
TP53 P04637 1/20 0.35
BMPR1A P36894 1/20 0.35
ACVR1 Q04771 1/20 0.35
IDO1 P14902 1/20 0.35
TNNI3K Q59H18 1/20 0.35
CYP3A4 P08684 1/20 0.34
SUCNR1 Q9BXA5 1/20 0.34
MPL P40238 1/20 0.34

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
SCHEMBL12424774 0.94 IGF1R (0.40) IGF1REGFRERBB3TGFBR1ACVRL1
SCHEMBL12426284 0.89 IGF1R (0.41) IGF1REGFRERBB3TGFBR1ACVRL1
SCHEMBL12424683 0.87 EGFR (0.39) IGF1REGFRERBB3TGFBR1ACVRL1
SCHEMBL12424786 0.87 EGFR (0.44) IGF1REGFRERBB3TGFBR1ACVRL1
SCHEMBL12425348 0.87 EGFR (0.40) IGF1REGFRERBB3TGFBR1ACVRL1
SCHEMBL12425340 0.87 IGF1R (0.41) IGF1REGFRERBB3TGFBR1ACVRL1
SCHEMBL12426294 0.86 TGFBR1 (0.41) IGF1REGFRERBB3TGFBR1ACVRL1
SCHEMBL12425349 0.85 EGFR (0.45) IGF1REGFRERBB3TGFBR1ACVRL1
SCHEMBL12424827 0.85 ACP1 (0.39) IGF1REGFRERBB3TGFBR1ACVRL1
SCHEMBL12424821 0.83 TGFBR1 (0.42) IGF1REGFRERBB3TGFBR1ACVRL1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2539336-B1 HETARYLAMINONAPHTHYRIDINES MERCK PATENT GMBH (DE) 2014-10-22 EP disclosed
US-8815893-B2 Hetarylaminonaphthyridines MERCK PATENT GMBH (DE) 2014-08-26 US disclosed
US-8815893-B2 Hetarylaminonaphthyridines MERCK PATENT GMBH (DE) 2014-08-26 US disclosed
US-20120316166-A1 HETARYLAMINONAPHTHYRIDINES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2012-12-13 US disclosed
US-20120316166-A1 HETARYLAMINONAPHTHYRIDINES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2012-12-13 US disclosed
WO-2011101069-A2 HETARYLAMINONAPHTHYRIDINES MERCK PATENT GMBH (DE) 2011-08-25 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-20120316166-A1 HETARYLAMINONAPHTHYRIDINES ATP5ME, ATP5F1A, ATP5F1D IGF1R 867/4885EGFR 846/4885ERBB3 542/4885

“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.