Phenyl Salicylate

Phenyl Salicylate

SCHEMBL28115280

CC(C)(C)CC(C)(C)OC(=O)c1ccccc1Oc1ccccc1.O=C(Oc1ccccc1)c1ccccc1O

nearest known ligand 0.55

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 4/20 0.55
HPGD P15428 3/20 0.55
ALOX15 P16050 1/20 0.55
ALDH1A1 P00352 3/20 0.45
KDM4E B2RXH2 1/20 0.45
NPSR1 Q6W5P4 3/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
MAPT P10636 4/20 0.43
CYP1A2 P05177 2/20 0.42
CYP2C9 P11712 2/20 0.42
CYP2C19 P33261 2/20 0.42
CTNNB1 P35222 1/20 0.41
KMT2A Q03164 3/20 0.40
TSHR P16473 2/20 0.40
MEN1 O00255 2/20 0.40
MAPK1 P28482 1/20 0.40
SCN1A P35498 1/20 0.40
SCN2A Q99250 1/20 0.40
SCN3A Q9NY46 1/20 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
Phenyl Salicylate SCHEMBL28072532 0.79 HSD17B10 (0.73) HSD17B10HPGDALOX15ALDH1A1KDM4E
Phenyl Salicylate SCHEMBL30008744 0.79 HSD17B10 (0.73) HSD17B10HPGDALOX15ALDH1A1KDM4E
SCHEMBL767125 0.77 CTNNB1 (0.65) HSD17B10HPGDALOX15ALDH1A1KDM4E
Phenyl Salicylate SCHEMBL11701951 0.77 MAPT (0.60) HSD17B10HPGDALOX15ALDH1A1KDM4E
SCHEMBL9769889 0.76 NPSR1 (0.58) HPGDNPSR1L3MBTL1SMN1; SMN2MAPT
Phenyl Salicylate SCHEMBL11615498 0.76 HSD17B10 (0.83) HSD17B10HPGDALOX15ALDH1A1KDM4E
SCHEMBL8369356 0.76 HSD17B10 (0.83) HSD17B10HPGDALOX15ALDH1A1KDM4E
SCHEMBL10408226 0.74 HSD17B10 (0.69) HSD17B10HPGDALOX15ALDH1A1KDM4E
SCHEMBL9467858 0.74 CTNNB1 (0.57) HSD17B10ALDH1A1KDM4ENPSR1L3MBTL1
SCHEMBL9133035 0.74 TSHR (0.47) HSD17B10ALDH1A1L3MBTL1SMN1; SMN2CYP2C19

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
CN-106232650-A The manufacture method of active energy ray-curable resin combination, resin forming product and resin forming product 三菱丽阳株式会社 2016-12-14 CN disclosed