SCHEMBL28935007

SCHEMBL28935007

Cc1cccc(-c2c(O)cccc2-c2ccccc2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 7/20 0.54
CNR1 P21554 5/20 0.54
ALDH1A1 P00352 2/20 0.50
HPGD P15428 2/20 0.50
BCL2L1 Q07817 1/20 0.50
HSD17B10 Q99714 1/20 0.50
BACE1 P56817 3/20 0.47
L3MBTL1 Q9Y468 2/20 0.46
ACLY P53396 1/20 0.46
TSHR P16473 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
USP2 O75604 1/20 0.42
ELANE P08246 1/20 0.42
CYP3A4 P08684 1/20 0.42
MAPT P10636 1/20 0.42
MAPK1 P28482 1/20 0.42
BRCA1 P38398 1/20 0.42
RECQL P46063 1/20 0.42
KMT2A Q03164 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
SCHEMBL28332750 0.85 HDAC8 (0.42) CNR2CNR1ALDH1A1HPGDBCL2L1
SCHEMBL5708395 0.85 CNR2 (0.47) CNR2CNR1ALDH1A1HPGDL3MBTL1
SCHEMBL5459938 0.84 CNR2 (0.53) CNR2CNR1HPGDBACE1L3MBTL1
SCHEMBL28691947 0.84 ALDH1A1 (0.52) ALDH1A1HPGDBCL2L1HSD17B10BACE1
SCHEMBL11786977 0.84 ALDH1A1 (0.52) ALDH1A1HPGDBCL2L1HSD17B10BACE1
SCHEMBL18150 0.82 ALDH1A1 (0.65) ALDH1A1HPGDBCL2L1HSD17B10BACE1
SCHEMBL28811416 0.82 GRM5 (0.44) CNR2CNR1ALDH1A1L3MBTL1ACLY
SCHEMBL6564117 0.81 RAB9A (0.46) CNR2CNR1ALDH1A1HPGDL3MBTL1
SCHEMBL2411804 0.81 CNR2 (0.58) CNR2CNR1ALDH1A1HPGDBCL2L1
SCHEMBL29360255 0.81 CNR2 (0.58) CNR2CNR1ALDH1A1HPGDBCL2L1

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-108430970-B Bisphenol compound and aromatic polycarbonate 本州化学工业株式会社 2022-03-11 CN disclosed