SCHEMBL27936152

SCHEMBL27936152

CCOC(=O)C1(c2ccccc2)OC1N

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 7/20 0.48
OPRD1 P41143 5/20 0.47
OPRK1 P41145 5/20 0.47
SLC22A1 O15245 2/20 0.47
SLC6A4 P31645 1/20 0.47
ADRA1A P35348 1/20 0.47
KCNH2 Q12809 1/20 0.47
GLA P06280 1/20 0.43
CTDSP1 Q9GZU7 1/20 0.43
KCNA3 P22001 2/20 0.42
TSHR P16473 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL57715 0.86 OPRM1 (0.49) OPRM1OPRD1OPRK1SLC22A1SLC6A4
SCHEMBL28177965 0.84 OPRM1 (0.45) OPRM1OPRD1OPRK1SLC22A1SLC6A4
SCHEMBL28994067 0.83 OPRM1 (0.47) OPRM1OPRD1OPRK1SLC22A1SLC6A4
SCHEMBL14967798 0.82 TSHR (0.47) OPRM1OPRD1OPRK1SLC22A1SLC6A4
SCHEMBL28016390 0.80 OPRM1 (0.44) OPRM1OPRD1OPRK1SLC22A1SLC6A4
SCHEMBL14967133 0.79 OPRM1 (0.43) OPRM1OPRD1OPRK1SLC22A1SLC6A4
SCHEMBL14967931 0.76 ALDH1A1 (0.46) OPRM1TSHRSMN1; SMN2
SCHEMBL10831134 0.75 OPRM1 (0.48) OPRM1OPRD1OPRK1SLC22A1SLC6A4
SCHEMBL9511995 0.74 ALDH1A1 (0.41) OPRM1SLC22A1TSHR
SCHEMBL28994070 0.74 ALDH1A1 (0.47) TSHRSMN1; SMN2

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-103555590-B Geotrichum candidum and its application in preparation of (2R, 3S)-ethyl phenyl glycidate UNIV ZHEJIANG TECHNOLOGY 2015-05-27 CN disclosed
CN-103555590-A Geotrichum candidum and its application in preparation of (2R, 3S)-ethyl phenyl glycidate UNIV ZHEJIANG TECHNOLOGY 2014-02-05 CN disclosed