SCHEMBL30193009

SCHEMBL30193009

C=C(C)c1ccc(CNC(=O)OC(C)(C)C)c(F)c1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 3/20 0.49
NR1H4 Q96RI1 2/20 0.49
KDM4A O75164 1/20 0.41
HDAC10 Q969S8 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
TRPA1 O75762 1/20 0.38
NAMPT P43490 1/20 0.38
HDAC1 Q13547 2/20 0.38
KCNA5 P22460 1/20 0.38
BDKRB1 P46663 3/20 0.38
CYP17A1 P05093 1/20 0.37
KLKB1 P03952 1/20 0.37
RIPK1 Q13546 1/20 0.36
MTNR1A P48039 1/20 0.36
MTNR1B P49286 1/20 0.36
IDO1 P14902 1/20 0.36

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
SCHEMBL23832914 1.00 EPHX2 (0.49) EPHX2NR1H4KDM4AHDAC10HDAC6
SCHEMBL1495902 0.87 EPHX2 (0.64) EPHX2NR1H4KDM4AHDAC10HDAC6
SCHEMBL1495955 0.86 EPHX2 (0.50) EPHX2NR1H4KDM4ABDKRB1
SCHEMBL30193362 0.85 EPHX2 (0.49) EPHX2NR1H4KDM4AHDAC10HDAC6
SCHEMBL23832978 0.85 EPHX2 (0.49) EPHX2NR1H4KDM4AHDAC10HDAC6
SCHEMBL30739196 0.84 EPHX2 (0.48) EPHX2NR1H4KDM4AHDAC10HDAC6
SCHEMBL15729681 0.84 EPHX2 (0.54) EPHX2NR1H4KDM4AHDAC10HDAC6
SCHEMBL507345 0.84 EPHX2 (0.48) EPHX2NR1H4KDM4AHDAC10HDAC6
SCHEMBL21996281 0.83 EPHX2 (0.43) EPHX2NR1H4KDM4AKCNA5BDKRB1
SCHEMBL30739096 0.82 EPHX2 (0.47) EPHX2NR1H4KDM4AHDAC10HDAC6

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-4121055-A1 STAT DEGRADERS AND USES THEREOF Kymera Therapeutics, Inc. (US) 2023-01-25 EP disclosed