SCHEMBL30974598

SCHEMBL30974598

NC(=O)c1cc(F)ccc1Oc1cccc(-c2ccccc2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTNNB1 P35222 1/20 0.55
SIRT2 Q8IXJ6 2/20 0.47
SIRT1 Q96EB6 2/20 0.47
PLAU P00749 2/20 0.46
PLG P00747 1/20 0.46
SCN8A Q9UQD0 1/20 0.45
SCN10A Q9Y5Y9 1/20 0.45
DHODH Q02127 2/20 0.44
IKBKB O14920 1/20 0.43
USP2 O75604 1/20 0.42
KMT2A Q03164 1/20 0.42
KDM4E B2RXH2 1/20 0.42
POLB P06746 1/20 0.42
BRD4 O60885 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MRGPRX4 Q96LA9 1/20 0.41
SLC1A5 Q15758 1/20 0.41
PARP10 Q53GL7 1/20 0.40
HTR2A P28223 1/20 0.40
SLC6A4 P31645 1/20 0.40

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
SCHEMBL29251266 1.00 CTNNB1 (0.55) CTNNB1SIRT2SIRT1PLAUPLG
SCHEMBL27549107 0.89 CTNNB1 (0.70) CTNNB1SIRT2SIRT1SCN8ASCN10A
SCHEMBL30974578 0.84 KDM4E (0.46) PLAUPLGSCN8ASCN10ADHODH
SCHEMBL29250437 0.84 KDM4E (0.46) PLAUPLGSCN8ASCN10ADHODH
SCHEMBL30974617 0.84 CTNNB1 (0.51) CTNNB1SIRT2SIRT1IKBKBKDM4E
SCHEMBL29251268 0.84 CTNNB1 (0.51) CTNNB1SIRT2SIRT1IKBKBKDM4E
SCHEMBL29250441 0.83 CTNNB1 (0.47) CTNNB1SCN8ASCN10APARP10
SCHEMBL30974590 0.82 ALDH1A1 (0.50) CTNNB1SIRT2SIRT1USP2KMT2A
SCHEMBL29250840 0.82 ALDH1A1 (0.50) CTNNB1SIRT2SIRT1USP2KMT2A
SCHEMBL30974625 0.82 CTNNB1 (0.47) CTNNB1SIRT2SIRT1SCN8ASCN10A

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