SCHEMBL29508368

SCHEMBL29508368

COc1c(O)cc2c(=O)oc3c(OC)c(O)cc4c(=O)oc1c2c34

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 1.00
MEN1 O00255 3/20 1.00
MAPT P10636 3/20 1.00
HPGD P15428 3/20 1.00
RECQL P46063 3/20 1.00
BLM P54132 3/20 1.00
KMT2A Q03164 3/20 1.00
ALDH1A1 P00352 3/20 1.00
APEX1 P27695 2/20 1.00
TDP1 Q9NUW8 2/20 1.00
RELA Q04206 1/20 0.85
CA12 O43570 2/20 0.65
CA1 P00915 2/20 0.65
CA7 P43166 2/20 0.65
CA9 Q16790 2/20 0.65
CA13 Q8N1Q1 2/20 0.65
MAOA P21397 5/20 0.59
CCNA2 P20248 2/20 0.59
CDK2 P24941 2/20 0.59
TP53 P04637 2/20 0.59

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
SCHEMBL941032 1.00 KDM4E (1.00) KDM4EMEN1MAPTHPGDRECQL
SCHEMBL2355138 0.94 KDM4E (0.88) KDM4EMEN1MAPTHPGDRECQL
SCHEMBL30608638 0.92 RELA (1.00) KDM4EMEN1MAPTHPGDRECQL
SCHEMBL941424 0.92 RELA (1.00) KDM4EMEN1MAPTHPGDRECQL
SCHEMBL13805434 0.89 KDM4E (0.80) KDM4EMEN1MAPTHPGDRECQL
SCHEMBL38658338 0.89 CA12 (0.84) KDM4EMEN1MAPTHPGDRECQL
SCHEMBL940860 0.83 CA12 (0.84) KDM4EMEN1MAPTHPGDRECQL
SCHEMBL2357687 0.83 KDM4E (0.68) KDM4EMEN1MAPTHPGDRECQL
SCHEMBL10079564 0.80 ALDH1A1 (0.67) KDM4EMEN1MAPTHPGDRECQL
SCHEMBL3796697 0.80 CA12 (0.82) KDM4EMEN1MAPTHPGDRECQL

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
WO-2024210297-A1 NOVEL COMPOUND DERIVED FROM CHESTNUT PERICARP AND COMPOSITION CONTAINING SAME FOR REDUCING HAIR LOSS 연세대학교 산학협력단 2024-10-10 WO disclosed
WO-2022055012-A1 USE OF CHOEROSPONDIAS AXILLARIS EXTRACT 주식회사 드래곤이뮤노 2022-03-17 WO disclosed