SCHEMBL2365415

SCHEMBL2365415

Fc1ccccc1-c1cc(-c2cncc(-c3cnn(CCOC4CCCCO4)c3)c2)c2cccnc2n1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MET P08581 3/20 0.49
KDM4C Q9H3R0 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.37
FEN1 P39748 2/20 0.34
ATR Q13535 1/20 0.34
TGFBR1 P36897 2/20 0.33
MAP4K4 O95819 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
IRAK4 Q9NWZ3 1/20 0.32
P2RX3 P56373 1/20 0.32
PDK2 Q15119 2/20 0.31
RORC P51449 1/20 0.31
HCRTR1 O43613 1/20 0.31
HCRTR2 O43614 1/20 0.31

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
SCHEMBL10153189 0.85 MET (0.49) METKDM4CL3MBTL1FEN1ATR
SCHEMBL12524909 0.83 MET (0.44) METKDM4CL3MBTL1ATRTGFBR1
SCHEMBL12440010 0.81 MAPK1 (0.44) FEN1TGFBR1MAP4K4
SCHEMBL2327583 0.80 MET (0.41) METFEN1TGFBR1MAP4K4PDK2
SCHEMBL320160 0.80 MET (0.47) METKDM4CL3MBTL1FEN1ATR
SCHEMBL2323346 0.80 FEN1 (0.47) METFEN1TGFBR1MAP4K4PDK2
SCHEMBL2329554 0.79 MAPK1 (0.41) FEN1MAP4K4IRAK4
SCHEMBL12440215 0.79 FEN1 (0.39) METFEN1TGFBR1MAP4K4NPC1
SCHEMBL2324685 0.78 PIM1 (0.47) METFEN1TGFBR1NPC1PDK2
SCHEMBL13834256 0.76 KDR (0.44) METFEN1TGFBR1MAP4K4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2531500-B1 HETARYL-[1,8]NAPHTHYRIDINE DERIVATIVES MERCK PATENT GMBH (DE) 2018-01-24 EP disclosed
US-8912216-B2 Hetaryl-[1,8]naphthyridine derivatives MERCK PATENT GMBH (DE) 2014-12-16 US disclosed
US-8912216-B2 Hetaryl-[1,8]naphthyridine derivatives MERCK PATENT GMBH (DE) 2014-12-16 US disclosed
US-8912216-B2 Hetaryl-[1,8]naphthyridine derivatives MERCK PATENT GMBH (DE) 2014-12-16 US disclosed
US-20140038960-A1 Hetaryl-[1,8]naphthyridine derivatives MERCK PATENT GMBH (DE) 2014-02-06 US disclosed
US-20140038960-A1 Hetaryl-[1,8]naphthyridine derivatives MERCK PATENT GMBH (DE) 2014-02-06 US disclosed
US-20140038960-A1 Hetaryl-[1,8]naphthyridine derivatives MERCK PATENT GMBH (DE) 2014-02-06 US disclosed
US-8614226-B2 Hetaryl-[1,8]naphthyridine derivatives MERCK PATENT GMBH (DE) 2013-12-24 US disclosed
EP-2531500-A1 HETARYL-[1,8]NAPHTHYRIDINE DERIVATIVES Merck Patent GmbH (DE) 2012-12-12 EP disclosed
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
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 (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-20140038960-A1 Hetaryl-[1,8]naphthyridine derivatives ATP5F1A, ATP5ME, ATP5F1D MET 2262/4885KDM4C 3659/4885L3MBTL1 2120/4885
US-20120295902-A1 Hetaryl-[1,8]naphthyridine derivatives ATP5F1A, ATP5ME, ATP5F1D MET 2262/4885KDM4C 3659/4885L3MBTL1 2120/4885

“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.