SCHEMBL8927808

SCHEMBL8927808

CC(COc1ccc(C(=O)c2ccccc2)c(O)c1)OC(=O)CO

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 6/20 0.58
ALDH1A1 P00352 6/20 0.55
LMNA P02545 5/20 0.55
MAPK1 P28482 3/20 0.55
CYP1A2 P05177 2/20 0.55
PGR P06401 2/20 0.55
SLC6A2 P23975 2/20 0.55
CYP2C19 P33261 2/20 0.55
HTT P42858 2/20 0.55
CYP2D6 P10635 1/20 0.55
PDE4A P27815 1/20 0.55
HRH1 P35367 1/20 0.55
SLC6A3 Q01959 1/20 0.55
PDE4D Q08499 1/20 0.55
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
USP2 O75604 1/20 0.48
GAA P10253 1/20 0.48
KEAP1 Q14145 1/20 0.48
NFE2L2 Q16236 1/20 0.48

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
SCHEMBL6545279 0.85 HPGD (0.63) HPGDALDH1A1LMNAMAPK1CYP1A2
SCHEMBL3359451 0.84 HPGD (0.53) HPGDALDH1A1LMNAMAPK1CYP1A2
SCHEMBL2775710 0.84 HPGD (0.53) HPGDALDH1A1LMNAMAPK1CYP1A2
SCHEMBL24376194 0.84 HPGD (0.65) HPGDALDH1A1LMNAMAPK1CYP1A2
SCHEMBL29969473 0.84 HPGD (0.65) HPGDALDH1A1LMNAMAPK1CYP1A2
SCHEMBL11599955 0.82 HPGD (0.62) HPGDALDH1A1LMNAMAPK1CYP1A2
SCHEMBL2930006 0.81 HPGD (0.50) HPGDALDH1A1LMNAMAPK1CYP1A2
SCHEMBL17409253 0.81 HPGD (0.62) HPGDALDH1A1LMNAMAPK1CYP1A2
SCHEMBL12456935 0.80 HPGD (0.59) HPGDALDH1A1LMNAMAPK1CYP1A2
SCHEMBL9208030 0.80 HPGD (0.62) HPGDALDH1A1LMNAMAPK1CYP1A2

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
JP-9255545-A None JP disclosed
JP-H09255545-A SKIN PREPARATION FOR EXTERNAL USE SHISEIDO CO LTD 1997-09-30 JP disclosed