SCHEMBL11261166

SCHEMBL11261166

CC(C)CC[N+]1([O-])CCC(Cc2ccccc2)(Oc2ccccc2)CC1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ OPRM1 P35372 2/20 0.33
▸ MMP9 P14780 1/20 0.32
▸ MAOA P21397 1/20 0.30
▸ MAOB P27338 1/20 0.30
▸ CTSL P07711 2/20 0.30
▸ CTSB P07858 2/20 0.30
▸ CTSK P43235 2/20 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
SCHEMBL11249863 0.84 OPRM1 (0.36) OPRM1MMP9MAOAMAOBCTSL
SCHEMBL11260619 0.83 MAOA (0.34) MEN1KMT2AOPRM1MAOAMAOB
SCHEMBL11266397 0.80 MAOA (0.36) MEN1KMT2AOPRM1MAOAMAOB
SCHEMBL11154795 0.74 DRD2 (0.40) MEN1KMT2A
SCHEMBL11165081 0.71 CYP2D6 (0.50) MEN1KMT2A
SCHEMBL11149158 0.68 MC4R (0.42) MEN1KMT2AOPRM1MAOAMAOB
SCHEMBL11247084 0.68 MEN1 (0.52) MEN1KMT2AOPRM1
SCHEMBL11153360 0.68 TACR1 (0.43) MEN1KMT2AOPRM1MAOAMAOB
SCHEMBL11149109 0.66 KDM4E (0.47) MEN1KMT2AOPRM1
SCHEMBL11151306 0.64 OPRL1 (0.54) MEN1KMT2AOPRM1

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-4333942-A Anti-depressant and analgesic 4-phenoxypiperidines BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1982-06-08 — — US disclosed
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