SCHEMBL12424765

SCHEMBL12424765

CCN(CCOc1cnccc1Nc1cc(-c2cc(Cl)ccc2F)nc2ncccc12)C(=O)OC(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 20/20 0.45
ACVR1B P36896 14/20 0.45
ACVRL1 P37023 12/20 0.45
ACVR1 Q04771 2/20 0.40
BMPR1A P36894 1/20 0.39
CYP3A4 P08684 1/20 0.38

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
SCHEMBL12425328 0.85 NR4A2 (0.44) TGFBR1ACVR1BACVRL1ACVR1BMPR1A
SCHEMBL12425352 0.83 IDO1 (0.43) TGFBR1ACVR1BACVRL1ACVR1BMPR1A
SCHEMBL12424816 0.82 TGFBR1 (0.44) TGFBR1ACVR1BACVRL1ACVR1BMPR1A
SCHEMBL12424676 0.82 TGFBR1 (0.46) TGFBR1ACVR1BACVRL1ACVR1BMPR1A
SCHEMBL12424766 0.81 TGFBR1 (0.41) TGFBR1ACVR1BACVRL1ACVR1BMPR1A
SCHEMBL2294813 0.76 TGFBR1 (0.66) TGFBR1ACVR1BACVRL1ACVR1BMPR1A
SCHEMBL2298025 0.75 EGFR (0.42) TGFBR1
SCHEMBL12424790 0.75 TGFBR1 (0.64) TGFBR1ACVR1BACVRL1ACVR1BMPR1A
SCHEMBL12425323 0.75 TGFBR1 (0.46) TGFBR1ACVR1BACVRL1ACVR1BMPR1A
SCHEMBL12424824 0.75 TGFBR1 (0.58) TGFBR1ACVR1BACVRL1ACVR1BMPR1A

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 TGFBR1 3742/4885ACVR1B 4144/4885ACVRL1 4102/4885

“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.