SCHEMBL30740852

SCHEMBL30740852

CC(C)(C)OC(=O)N1CCCCC1Oc1cccc(CO)n1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 2/20 0.41
▸ ALDH1A1 P00352 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ UCHL1 P09936 2/20 0.38
▸ GPR119 Q8TDV5 3/20 0.38
▸ HRH3 Q9Y5N1 1/20 0.38
▸ GRM5 P41594 1/20 0.38
▸ NR1H2 P55055 1/20 0.38
▸ NR1H3 Q13133 1/20 0.38
▸ MAPT P10636 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ KDM1A O60341 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ PDE8B O95263 1/20 0.37

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
SCHEMBL29826100 0.81 GPR119 (0.56) GPR119HRH3KDM1A
SCHEMBL27111204 0.81 GPR119 (0.56) GPR119HRH3KDM1A
SCHEMBL30740740 0.81 TRPV3 (0.39) ALDH1A1LMNATSHRGPR119NR1H2
SCHEMBL30740730 0.81 MRGPRX4 (0.46) ALDH1A1LMNATSHRUCHL1GRM5
SCHEMBL30740781 0.81 KDM1A (0.44) ALDH1A1LMNATSHRUCHL1MAPT
SCHEMBL30740755 0.78 LNPEP (0.38) ALDH1A1LMNAUCHL1GPR119NPSR1
SCHEMBL30740835 0.77 MAPT (0.42) HSD11B1UCHL1GPR119NR1H2NR1H3
SCHEMBL30740793 0.77 NPC1 (0.41) HSD11B1UCHL1GPR119KDM4EPOLB
SCHEMBL30740726 0.76 GPR119 (0.42) HSD11B1GPR119KDM4EPOLB
SCHEMBL29223963 0.76 GPR119 (0.48) HSD11B1ALDH1A1UCHL1GPR119KDM1A

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-117043154-A GPCR receptor agonists, pharmaceutical compositions comprising same, and methods of use thereof 卡莫特医疗有限公司 2023-11-10 — — CN disclosed
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