SCHEMBL22481815

SCHEMBL22481815

CC(O)COC(C)COc1ccc(C(C)(C)c2ccc(O)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 3/20 0.49
HTT P42858 1/20 0.49
AR P10275 3/20 0.48
SLC6A2 P23975 3/20 0.46
ESR1 P03372 3/20 0.46
ESR2 Q92731 3/20 0.46
HPGD P15428 3/20 0.46
TSHR P16473 3/20 0.46
CYP3A4 P08684 2/20 0.46
SLC6A4 P31645 2/20 0.46
SLC6A3 Q01959 2/20 0.46
HTR6 P50406 1/20 0.46
ESRRG P62508 1/20 0.46
HSD17B10 Q99714 1/20 0.46
PTGS1 P23219 1/20 0.44
LMNA P02545 1/20 0.42
KMT2A Q03164 4/20 0.41
ALDH1A1 P00352 4/20 0.41
ADRB3 P13945 3/20 0.40
ADRB2 P07550 2/20 0.40

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
SCHEMBL12082206 0.94 HIF1A (0.54) HIF1AHTTARHPGDTSHR
SCHEMBL13892365 0.90 HIF1A (0.55) HIF1AHTTARSLC6A2ESR1
SCHEMBL823191 0.90 HIF1A (0.55) HIF1AHTTARSLC6A2ESR1
SCHEMBL2046141 0.85 MAPT (0.48) HIF1AHTTARTSHRHSD17B10
SCHEMBL2046633 0.84 MAPT (0.47) HIF1AHTTARTSHRHSD17B10
SCHEMBL13830626 0.84 TSHR (0.50) HIF1AHTTARSLC6A2ESR1
SCHEMBL376300 0.83 HIF1A (0.61) HIF1AHTTARHPGDTSHR
SCHEMBL8462018 0.83 HIF1A (0.49) HIF1AHTTARSLC6A2ESR1
SCHEMBL24119613 0.82 HPGD (0.55) HIF1AHTTARSLC6A2ESR1
SCHEMBL13567688 0.82 HTT (0.65) HIF1AHTTARSLC6A2ESR1

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
WO-2020195712-A1 COMPOSITION FOR DIP MOLDING, METHOD FOR PRODUCING GLOVE USING SAME, AND GLOVE ミドリ安全株式会社 2020-10-01 WO disclosed