SCHEMBL29700474

SCHEMBL29700474

O=Cc1cccc(-c2ccccc2C=O)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 1/20 0.46
TRIM33 Q9UPN9 1/20 0.46
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA9 Q16790 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
AXL P30530 1/20 0.44
LMNA P02545 1/20 0.44
THRB P10828 1/20 0.44
BLM P54132 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
ALDH1A1 P00352 4/20 0.44
NAT1 P18440 3/20 0.43
CYP2A6 P11509 1/20 0.43
GRM5 P41594 1/20 0.42
BRD4 O60885 1/20 0.41
XDH P47989 1/20 0.41
ELANE P08246 1/20 0.41

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
SCHEMBL14650356 1.00 TRIM24 (0.46) TRIM24TRIM33CA12CA1CA2
SCHEMBL6851274 0.91 TRIM24 (0.54) TRIM24TRIM33CA12CA1CA2
SCHEMBL5490744 0.88 TRIM24 (0.52) TRIM24TRIM33CA12CA1CA2
SCHEMBL27514196 0.87 TDP1 (0.40) TRIM24TRIM33CA12CA1CA2
SCHEMBL13250832 0.84 TRIM24 (0.53) TRIM24TRIM33CA12CA1CA2
SCHEMBL5711323 0.83 LMNA (0.57) TRIM24TRIM33MEN1KMT2ALMNA
SCHEMBL19154057 0.82 MEN1 (0.46) TRIM24TRIM33MEN1KMT2ALMNA
SCHEMBL19180224 0.80 TRIM24 (0.54) TRIM24TRIM33CA12CA1CA2
SCHEMBL10700582 0.80 TRIM24 (0.40) TRIM24TRIM33CA12CA1CA2
SCHEMBL307118 0.79 ALDH1A1 (0.45) MEN1KMT2ALMNATHRBBLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4251313-A1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS Givaudan SA (CH) 2023-10-04 EP disclosed
CN-116457084-A Improvements in or relating to organic compounds 奇华顿股份有限公司 2023-07-18 CN disclosed
WO-2022112204-A1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2022-06-02 WO disclosed