SCHEMBL11099143

SCHEMBL11099143

COC(=O)CCCCC(=O)NCCO[C@H]1O[C@H](COC(=O)c2ccccc2)[C@H](O)[C@H](OCc2ccccc2)[C@H]1NC(C)=O

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 13/20 0.48
▸ SSTR3 P32745 5/20 0.48
▸ SSTR5 P35346 5/20 0.48
▸ SSTR2 P30874 3/20 0.48
▸ SSTR1 P30872 1/20 0.43
▸ SSTR4 P31391 1/20 0.43
▸ TACR1 P25103 1/20 0.41
▸ LMNA P02545 1/20 0.40
▸ KMT2A Q03164 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
SCHEMBL5428265 0.87 SSTR5 (0.47) MCHR1SSTR3SSTR5SSTR2SSTR1
SCHEMBL11095818 0.86 LMNA (0.48) LMNAKMT2A
SCHEMBL6810335 0.85 POLB (0.52) MCHR1SSTR3SSTR5SSTR2SSTR1
SCHEMBL10906318 0.84 MCHR1 (0.46) MCHR1SSTR3SSTR5SSTR2SSTR1
SCHEMBL15592304 0.78 LMNA (0.51) LMNAKMT2A
SCHEMBL8831298 0.78 SSTR5 (0.49) MCHR1SSTR3SSTR5SSTR2SSTR1
SCHEMBL6810337 0.78 POLB (0.55) SSTR3SSTR5SSTR2SSTR1SSTR4
SCHEMBL26120441 0.77 MCHR1 (0.44) MCHR1SSTR3SSTR5SSTR2SSTR1
SCHEMBL11094876 0.76 L3MBTL1 (0.66) MCHR1SSTR3SSTR5SSTR2LMNA
SCHEMBL15592376 0.75 LMNA (0.39) TACR1LMNAKMT2A

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
US-4442284-A Chemical compounds, aminoacid attached to glycoside BEHRINGWERKE AKTIENGESELLSCHAFT (DE) 1984-04-10 — — US disclosed
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