SCHEMBL31344370

SCHEMBL31344370

COc1ccc2oc(O)c(-c3ccccc3)c(=O)c2c1O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGAM O43451 2/20 0.51
CYP1A1 P04798 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP1B1 Q16678 1/20 0.46
ALDH1A1 P00352 7/20 0.46
CYP3A4 P08684 5/20 0.46
MAPT P10636 5/20 0.46
HPGD P15428 4/20 0.46
CYP2C19 P33261 2/20 0.46
CYP2C9 P11712 1/20 0.46
MAOA P21397 1/20 0.46
ABCG2 Q9UNQ0 2/20 0.44
ABCB1 P08183 1/20 0.44
HK2 P52789 1/20 0.43
CCNE2 O96020 1/20 0.43
CDK1 P06493 1/20 0.43
CCNB1 P14635 1/20 0.43
CCNE1 P24864 1/20 0.43
CDK2 P24941 1/20 0.43
GSK3B P49841 1/20 0.43

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
SCHEMBL16827005 1.00 MGAM (0.51) MGAMCYP1A1CYP1A2CYP1B1ALDH1A1
SCHEMBL28719320 0.88 MEN1 (0.54) MGAMCYP1A1CYP1A2CYP1B1ALDH1A1
SCHEMBL27728665 0.88 MGAM (0.50) MGAMCYP1A1CYP1A2CYP1B1ALDH1A1
SCHEMBL20815507 0.86 ABCB1 (0.51) CYP1A1CYP1A2CYP1B1ALDH1A1CYP3A4
SCHEMBL6666764 0.82 CYP1B1 (0.60) MGAMCYP1A1CYP1A2CYP1B1ALDH1A1
SCHEMBL1255490 0.81 MEN1 (0.48) MGAMCYP1A1CYP1A2CYP1B1ALDH1A1
SCHEMBL27322035 0.80 FLT3 (0.64) MAPTMAOAABCB1KDM4EMEN1
SCHEMBL28167202 0.80 ALDH1A1 (0.47) MGAMCYP1A1CYP1A2CYP1B1ALDH1A1
SCHEMBL20579985 0.76 MAPT (0.64) MGAMALDH1A1CYP3A4MAPTHPGD
SCHEMBL30061409 0.76 MAPT (0.64) MGAMALDH1A1CYP3A4MAPTHPGD

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
CN-119110720-A Cosmetic composition 布茨公司 2024-12-10 CN claimed
CN-119110720-A Cosmetic composition 布茨公司 2024-12-10 CN disclosed