SCHEMBL23996139

SCHEMBL23996139

CCCOC(C)(C)C(=O)NCCC(C)N1CC1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CCR5 P51681 15/20 0.32
▸ CNR1 P21554 1/20 0.31
▸ CNR2 P34972 1/20 0.31
▸ UBE2M P61081 1/20 0.30
▸ DCUN1D1 Q96GG9 1/20 0.30
▸ USP2 O75604 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
SCHEMBL24121228 0.92 USP2 (0.34) CCR5CNR1CNR2UBE2MDCUN1D1
SCHEMBL23996138 0.83 — —
SCHEMBL23975338 0.81 — —
SCHEMBL12696512 0.73 CHRNB2 (0.40) CNR1CNR2
SCHEMBL12307258 0.71 MEN1 (0.47) CCR5
SCHEMBL12254884 0.70 NPSR1 (0.42) CCR5USP2
SCHEMBL27413462 0.70 CYP2C19 (0.43) CNR1CNR2USP2
SCHEMBL20407539 0.69 CCR5 (0.33) CCR5UBE2MDCUN1D1
SCHEMBL21672221 0.69 EPHX1 (0.31) —
SCHEMBL24601689 0.69 USP2 (0.32) USP2

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
US-20220177738-A1 ELASTIC ONE-PART STRUCTURAL ADHESIVE TAPE 3M INNOVATIVE PROPERTIES COMPANY 2022-06-09 — — US disclosed
US-11171370-B2 Aziridino-functional polyether thermally-conductive gap filler 3M INNOVATIVE PROPERTIES COMPANY (US) 2021-11-09 — — US disclosed
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