SCHEMBL2362701

SCHEMBL2362701

Nc1ccnc(-c2cc(-c3cccc(Cl)c3)nc3ncccc23)c1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 2/20 0.44
SYK P43405 1/20 0.43
MAP4K4 O95819 1/20 0.43
CAMK2D Q13557 1/20 0.43
ASIC3 Q9UHC3 3/20 0.42
HRH4 Q9H3N8 1/20 0.41
HCAR2 Q8TDS4 1/20 0.40
NUDT1 P36639 2/20 0.40
KMO O15229 1/20 0.40
CYP19A1 P11511 1/20 0.40
DHFR P00374 1/20 0.39
PLK1 P53350 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
SCHEMBL4251930 0.82 SYK (0.48) ABCG2SYKMAP4K4HRH4KMO
SCHEMBL2596769 0.80 ASIC3 (0.65) MAP4K4CAMK2DASIC3HRH4NUDT1
SCHEMBL246458 0.79 ABCG2 (0.48) ABCG2SYKMAP4K4NUDT1KMO
SCHEMBL2302917 0.75 NPC1 (0.46) ASIC3HCAR2
SCHEMBL4248549 0.72 ALDH1A1 (0.55) KMO
SCHEMBL4106824 0.72 ASIC3 (0.50) MAP4K4CAMK2DASIC3HRH4KMO
SCHEMBL11364757 0.71 SYK (0.60) SYKMAP4K4HRH4CYP19A1DHFR
SCHEMBL12425137 0.70 TGFBR1 (0.49) ABCG2SYKMAP4K4PLK1
SCHEMBL12692408 0.70 ASIC3 (0.53) ASIC3DHFR
SCHEMBL2328465 0.69 MET (0.42)

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 5 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
EP-2539336-A2 HETARYLAMINONAPHTHYRIDINES Merck Patent GmbH (DE) 2013-01-02 EP 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 ABCG2 175/4885SYK 3462/4885MAP4K4 2697/4885

“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.