SCHEMBL28083583

SCHEMBL28083583

C[C@H](COc1ccc(O)cc1)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 3/20 0.50
PTGS1 P23219 2/20 0.50
ADRB2 P07550 1/20 0.44
ADRB1 P08588 1/20 0.44
ADRB3 P13945 1/20 0.44
LMNA P02545 3/20 0.44
CYP1A2 P05177 2/20 0.44
CYP2C19 P33261 2/20 0.44
SLC6A3 Q01959 2/20 0.44
HIF1A Q16665 2/20 0.44
LTA4H P09960 1/20 0.44
PTGS2 P35354 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
MTNR1A P48039 3/20 0.44
MTNR1B P49286 3/20 0.44
MAPT P10636 2/20 0.43
POLB P06746 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
MEN1 O00255 1/20 0.43
HTR1A P08908 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
SCHEMBL28255815 1.00 SLC6A2 (0.50) SLC6A2PTGS1ADRB2ADRB1ADRB3
SCHEMBL11006473 1.00 SLC6A2 (0.50) SLC6A2PTGS1ADRB2ADRB1ADRB3
SCHEMBL14273066 0.85 L3MBTL1 (0.53) LMNACYP1A2CYP2C19MTNR1AMTNR1B
SCHEMBL31032939 0.85 LMNA (0.62) PTGS1ADRB2ADRB1ADRB3LMNA
SCHEMBL15866588 0.85 LMNA (0.62) PTGS1ADRB2ADRB1ADRB3LMNA
SCHEMBL787266 0.85 LMNA (0.62) PTGS1ADRB2ADRB1ADRB3LMNA
SCHEMBL1305299 0.84 PPARA (0.58) CYP1A2MEN1KMT2A
SCHEMBL21895800 0.84 PPARA (0.58) CYP1A2MEN1KMT2A
SCHEMBL787523 0.84 TDP1 (0.49) PTGS1LMNAMTNR1AMTNR1BMAPT
SCHEMBL28619870 0.84 PPARA (0.58) CYP1A2MEN1KMT2A

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-106065005-B Preparation method of R- (+) -2- [4- (hydroxyphenoxy) ] propionate 锦州四海生物化学有限公司 2021-01-01 CN disclosed
CN-105753656-A Synthesizing method for (R)-(+)-2-(4-hydroxy phenoxy) methyl propionate 张家港市三联化工科技有限公司 2016-07-13 CN disclosed