SCHEMBL19154148

SCHEMBL19154148

CCCC(C)[C@]1(c2ccccc2)CC[C@@](CCCCOC)(CN(CCC(=O)NCC(N)=O)C(N)=O)CC1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 8/20 0.42
▸ OPRL1 P41146 4/20 0.39
▸ TACR1 P25103 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ SLC6A2 P23975 1/20 0.30
▸ SLC6A4 P31645 1/20 0.30

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
SCHEMBL19094417 0.59 OPRM1 (1.00) OPRM1OPRL1
SCHEMBL19094418 0.59 OPRM1 (1.00) OPRM1OPRL1
SCHEMBL19116454 0.59 OPRM1 (0.70) OPRM1OPRL1
SCHEMBL7773649 0.54 HDAC1 (0.62) LMNAHPGD
SCHEMBL20054844 0.54 MME (0.39) OPRM1OPRL1SLC6A2
SCHEMBL6228602 0.54 OPRM1 (0.40) OPRM1OPRL1SLC6A2SLC6A4
SCHEMBL29156157 0.54 ESR1 (0.39) OPRM1KDM4ELMNASLC6A2SLC6A4
SCHEMBL7773734 0.54 HDAC1 (0.61) LMNAMEN1HPGDKMT2A
SCHEMBL27262560 0.54 SLC6A4 (0.46) OPRM1OPRL1SLC6A2SLC6A4
SCHEMBL13849911 0.53 OPRM1 (0.44) OPRM1OPRL1LMNASLC6A2

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
WO-2017121646-A1 3-(CARBOXYETHYL)-8-AMINO-2-OXO-1,3-DIAZA-SPIRO-[4.5]-DECANE DERIVATIVES Grünenthal GmbH (DE) 2017-07-20 — — WO disclosed
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