SCHEMBL29044930

SCHEMBL29044930

COc1c(O)c(O)c(C(=O)c2ccccc2O)c(O)c1S(=O)(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.43
CYP2C19 P33261 3/20 0.43
HPGD P15428 3/20 0.43
AR P10275 2/20 0.43
CYP1A2 P05177 2/20 0.43
PGR P06401 2/20 0.43
SLC6A2 P23975 2/20 0.43
CYP3A4 P08684 1/20 0.43
ADORA3 P0DMS8 1/20 0.43
CHRM1 P11229 1/20 0.43
ALOX15 P16050 1/20 0.43
TBXA2R P21731 1/20 0.43
ADRA1A P35348 1/20 0.43
HIF1A Q16665 1/20 0.43
TSHR P16473 1/20 0.41
ALDH1A1 P00352 6/20 0.40
MAPT P10636 4/20 0.40
STS P08842 1/20 0.39
KMT2A Q03164 3/20 0.38
LIG1 P18858 1/20 0.36

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
SCHEMBL10766603 0.85 HPGD (0.53) LMNACYP2C19HPGDARCYP1A2
SCHEMBL2048962 0.84 LMNA (0.43) LMNACYP2C19HPGDARCYP1A2
SCHEMBL1356361 0.83 LMNA (0.43) LMNACYP2C19HPGDARCYP1A2
SCHEMBL27643290 0.75 HPGD (0.51) LMNACYP2C19HPGDARCYP1A2
SCHEMBL8428996 0.74 LMNA (0.51) LMNACYP2C19HPGDARCYP1A2
SCHEMBL1063410 0.74 LIG1 (0.55) LMNACYP2C19HPGDARCYP1A2
SCHEMBL7832016 0.73 MAPT (0.46) LMNACYP2C19HPGDCYP1A2PGR
SCHEMBL10766866 0.73 KDM4E (0.47) LMNACYP2C19HPGDARCYP1A2
SCHEMBL23036909 0.72 MAPT (0.45) LMNACYP2C19HPGDCYP1A2PGR
SCHEMBL10770380 0.70 ALDH1A1 (0.42) LMNACYP2C19HPGDARCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119948103-A Resin composition and molded article thereof 帝人株式会社 2025-05-06 CN disclosed
CN-118647673-A Flame-retardant polycarbonate resin composition and molded article thereof 帝人株式会社 2024-09-13 CN disclosed
CN-118201981-A Polycarbonate resin, and optical lens and optical film using same 三菱瓦斯化学株式会社 2024-06-14 CN disclosed
CN-113383035-B Molding material comprising carbon fiber-reinforced polycarbonate resin composition 帝人株式会社 2023-08-01 CN disclosed