SCHEMBL28980463

SCHEMBL28980463

O=C(O)/C=C/c1ccc2cc(Br)ccc2n1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.62
LMNA P02545 2/20 0.62
MAPT P10636 2/20 0.53
ALDH1A1 P00352 2/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
HDAC6 Q9UBN7 7/20 0.50
HDAC8 Q9BY41 6/20 0.50
HDAC2 Q92769 6/20 0.50
HDAC1 Q13547 6/20 0.50
HDAC3 O15379 2/20 0.50
HDAC4 P56524 2/20 0.50
HDAC7 Q8WUI4 2/20 0.50
HDAC10 Q969S8 2/20 0.50
HDAC11 Q96DB2 2/20 0.50
HDAC9 Q9UKV0 2/20 0.50
HDAC5 Q9UQL6 2/20 0.50
PFKFB3 Q16875 2/20 0.47
CYP1A2 P05177 1/20 0.45

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
SCHEMBL30209657 0.86 MAPT (0.52) KDM4ELMNAMAPTALDH1A1MEN1
SCHEMBL3532231 0.81 KDM4E (0.62) KDM4ELMNAMAPTALDH1A1MEN1
SCHEMBL19643476 0.81 KDM4E (0.62) KDM4ELMNAMAPTALDH1A1MEN1
SCHEMBL3531030 0.81 KDM4E (0.62) KDM4ELMNAMAPTALDH1A1HDAC6
SCHEMBL3531024 0.81 KDM4E (0.62) KDM4ELMNAMAPTALDH1A1HDAC6
SCHEMBL3532228 0.81 KDM4E (0.62) KDM4ELMNAMAPTALDH1A1MEN1
SCHEMBL19643475 0.81 KDM4E (0.62) KDM4ELMNAMAPTALDH1A1MEN1
SCHEMBL30350579 0.79 KDM4E (0.49) KDM4ELMNAMAPTALDH1A1MEN1
SCHEMBL19511084 0.79 KDM4E (0.49) KDM4ELMNAMAPTALDH1A1MEN1
SCHEMBL3529705 0.79 HDAC8 (0.73) KDM4ELMNAMAPTALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107567443-B Biaryl derivatives as GPR120 agonists 株式会社LG化学 2023-04-28 CN disclosed
CN-115925679-A Biaryl derivatives as GPR120 agonists 株式会社LG化学 2023-04-07 CN disclosed