SCHEMBL30974591

SCHEMBL30974591

Cc1cccc(Oc2ccc(C)cc2C(N)=O)c1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.51
GAA P10253 1/20 0.51
L3MBTL1 Q9Y468 2/20 0.50
CTNNB1 P35222 1/20 0.50
LMNA P02545 1/20 0.47
KDM4E B2RXH2 1/20 0.47
POLB P06746 1/20 0.47
PARP1 P09874 1/20 0.46
HTT P42858 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
AR P10275 1/20 0.43
BRD4 O60885 3/20 0.43
SIRT2 Q8IXJ6 1/20 0.43
SIRT1 Q96EB6 1/20 0.43
PLAU P00749 1/20 0.42
MAPK1 P28482 1/20 0.42
GFER P55789 1/20 0.42
ACHE P22303 1/20 0.42

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
SCHEMBL29250431 1.00 ALDH1A1 (0.51) ALDH1A1GAAL3MBTL1CTNNB1LMNA
SCHEMBL29250580 0.89 CTNNB1 (0.65) GAACTNNB1KDM4EPOLBBRD4
SCHEMBL30974590 0.88 ALDH1A1 (0.50) ALDH1A1GAAL3MBTL1CTNNB1LMNA
SCHEMBL30974584 0.88 L3MBTL1 (0.63) ALDH1A1GAAL3MBTL1CTNNB1LMNA
SCHEMBL29250434 0.88 L3MBTL1 (0.63) ALDH1A1GAAL3MBTL1CTNNB1LMNA
SCHEMBL29250840 0.88 ALDH1A1 (0.50) ALDH1A1GAAL3MBTL1CTNNB1LMNA
SCHEMBL13687512 0.88 CTNNB1 (0.68) ALDH1A1GAAL3MBTL1CTNNB1LMNA
SCHEMBL30974594 0.86 POLB (0.63) ALDH1A1GAAL3MBTL1LMNAKDM4E
SCHEMBL10293213 0.86 POLB (0.63) ALDH1A1GAAL3MBTL1LMNAKDM4E
SCHEMBL30974566 0.83 KDM4E (0.49) ALDH1A1GAAL3MBTL1LMNAKDM4E

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
CN-118084706-A Synthesis method of 2- (4-hydroxyphenoxy) benzamide compound 河北科技大学 2024-05-28 CN disclosed