SCHEMBL7940985

SCHEMBL7940985

C=C(CC)c1ccc(C(=O)OC)nc1

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.68
KDM4E B2RXH2 2/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
P4HTM Q9NXG6 4/20 0.40
MAPT P10636 4/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
AHR P35869 1/20 0.40
P4HA1 P13674 1/20 0.40
MIF P14174 1/20 0.40
PKM P14618 1/20 0.39
POLB P06746 1/20 0.38
LCK P06239 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PARP1 P09874 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
SCHEMBL7882276 0.82 MAPK1 (0.74) MAPK1KDM4EL3MBTL1P4HTMMAPT
SCHEMBL1004608 0.82 MAPK1 (0.64) MAPK1KDM4EL3MBTL1P4HTMMAPT
SCHEMBL29508473 0.81 MAPK1 (1.00) MAPK1KDM4EL3MBTL1P4HTMMAPT
SCHEMBL69747 0.81 MAPK1 (1.00) MAPK1KDM4EL3MBTL1P4HTMMAPT
SCHEMBL7939167 0.80 MAPK1 (0.54) MAPK1KDM4EL3MBTL1NPC1RAB9A
SCHEMBL7356681 0.79 MAPK1 (0.75) MAPK1KDM4EL3MBTL1MEN1KMT2A
SCHEMBL989398 0.78 MAPK1 (0.79) MAPK1KDM4EL3MBTL1P4HTMMAPT
SCHEMBL64024 0.78 MAPK1 (0.79) MAPK1KDM4EL3MBTL1P4HTMMAPT
SCHEMBL29826109 0.78 MAPK1 (0.79) MAPK1KDM4EL3MBTL1P4HTMMAPT
SCHEMBL18940452 0.78 MAPK1 (0.68) MAPK1KDM4EL3MBTL1MAPTMEN1

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
WO-2010017079-A1 OXAZOLE DERIVATIVES USEFUL AS INHIBITORS OF FAAH MERCK & CO., INC. (US) 2010-02-11 WO disclosed