SCHEMBL29377753

SCHEMBL29377753

CC[C@H](CC(=O)OC)c1cccc(O)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 6/20 0.46
F10 P00742 6/20 0.46
PRSS1 P07477 5/20 0.45
HIF1A Q16665 3/20 0.44
LMNA P02545 2/20 0.44
GALR3 O60755 1/20 0.44
ADRB2 P07550 1/20 0.43
ADRB1 P08588 1/20 0.43
HTR1A P08908 1/20 0.43
ADRA2A P08913 1/20 0.43
ADRB3 P13945 1/20 0.43
TSHR P16473 1/20 0.43
ADRA2B P18089 1/20 0.43
ADRA2C P18825 1/20 0.43
NFKB1 P19838 1/20 0.43
DRD1 P21728 1/20 0.43
HTR7 P34969 1/20 0.43
ADRA1A P35348 1/20 0.43
ADRA1B P35368 1/20 0.43
DRD3 P35462 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
SCHEMBL2501601 1.00 F2 (0.46) F2F10PRSS1HIF1ALMNA
SCHEMBL2498458 1.00 F2 (0.46) F2F10PRSS1HIF1ALMNA
SCHEMBL12220590 1.00 F2 (0.46) F2F10PRSS1HIF1ALMNA
SCHEMBL2495278 0.88 F10 (0.50) F2F10PRSS1HIF1ALMNA
SCHEMBL27830823 0.88 F10 (0.50) F2F10PRSS1HIF1ALMNA
SCHEMBL2503014 0.88 F10 (0.50) F2F10PRSS1HIF1ALMNA
SCHEMBL12193281 0.87 F2 (0.45) F2F10PRSS1HIF1ALMNA
SCHEMBL2499245 0.87 F2 (0.45) F2F10PRSS1HIF1ALMNA
SCHEMBL2506034 0.87 F2 (0.45) F2F10PRSS1HIF1ALMNA
SCHEMBL5661841 0.87 F10 (0.48) F2F10PRSS1HIF1ALMNA

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-116472273-A Antidiabetic compounds and compositions 宁康瑞珠生物制药(珠海)有限公司 2023-07-21 CN disclosed
WO-2022028317-A1 ANTIDIABETIC COMPOUNDS AND COMPOSITIONS REZUBIO PHARMACEUTICALS CO., LTD (CN) 2022-02-10 WO disclosed