SCHEMBL2469754

SCHEMBL2469754

O=C(O)N(CCCN1CCNCC1)c1cccc(Cn2nc(-c3cc(F)cc(F)c3)ccc2=O)c1

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MET P08581 18/20 0.52
TSHR P16473 2/20 0.39
ALDH1A1 P00352 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
USP2 O75604 1/20 0.39

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
SCHEMBL2467247 0.95 MET (0.50) METTSHRALDH1A1L3MBTL1
SCHEMBL2469731 0.93 MET (0.54) METTSHRALDH1A1L3MBTL1
SCHEMBL1953412 0.91 MET (0.53) MET
SCHEMBL2470373 0.91 MET (0.43) METTSHRALDH1A1L3MBTL1USP2
SCHEMBL2468002 0.90 MET (0.65) METTSHR
SCHEMBL2472186 0.89 MET (0.52) MET
SCHEMBL2468076 0.88 MET (0.52) MET
SCHEMBL2472162 0.86 MET (0.52) METTSHRALDH1A1L3MBTL1
SCHEMBL2464470 0.85 MET (0.43) METTSHRALDH1A1L3MBTL1USP2
SCHEMBL2466209 0.85 MET (0.46) METTSHRALDH1A1L3MBTL1USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1960370-B1 PYRIDIAZINONE DERIVATIVES FOR TUMOUR TREATMENT MERCK PATENT GMBH (DE) 2011-10-05 EP claimed