SCHEMBL9958429

SCHEMBL9958429

O=C(Cc1ccccc1)NC(=O)Nc1ccc(Oc2c[c]ncc2)cc1F

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MET P08581 3/20 0.58
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA5A P35218 1/20 0.42
CA7 P43166 1/20 0.42
CA5B Q9Y2D0 1/20 0.42
MAPK14 Q16539 4/20 0.40
PPIA P62937 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
P2RY1 P47900 1/20 0.39
RAB9A P51151 1/20 0.39
POLB P06746 1/20 0.39
KDR P35968 2/20 0.39
MAPK13 O15264 1/20 0.39
BRAF P15056 1/20 0.39
LTA4H P09960 1/20 0.38
EPHX2 P34913 1/20 0.38
RIPK2 O43353 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
SCHEMBL9958107 0.91 MEN1 (0.51) METMEN1KMT2ARAB9AKDR
SCHEMBL5711089 0.88 KMT2A (0.46) METCA1CA2CA5ACA7
SCHEMBL5711096 0.88 MET (0.45) METMEN1KMT2ARAB9APOLB
SCHEMBL4340634 0.83 MET (0.64) METCA1CA2CA5ACA7
SCHEMBL27704478 0.83 NPC1 (0.46) METPPIARAB9APOLB
SCHEMBL6031858 0.82 MET (0.60) METKDR
SCHEMBL4340630 0.81 MET (0.62) METCA1CA2CA5ACA7
SCHEMBL9957603 0.80 MEN1 (0.51) METMEN1KMT2ARAB9A
SCHEMBL4321743 0.78 MET (0.59) METMAPK14KDRMAPK13BRAF
SCHEMBL5711099 0.77 MET (0.48) METMEN1KMT2ARAB9APOLB

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-1719762-B1 NOVEL PYRIDINE DERIVATIVE AND PYRIMIDINE DERIVATIVE (1) EISAI R&D MAN CO LTD (JP) 2012-06-27 EP disclosed