SCHEMBL28811494

SCHEMBL28811494

CNc1ccn(C2CCC(C)(C)CC2)c1

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 1/20 0.31
▸ CPB1 P15086 1/20 0.31
▸ OPRM1 P35372 1/20 0.30
▸ OPRL1 P41146 1/20 0.30
▸ OPRD1 P41143 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
SCHEMBL27713829 0.82 SLC18A3 (0.34) —
SCHEMBL28810749 0.80 CDK5 (0.33) —
SCHEMBL28810662 0.77 CPB1 (0.32) CPB1
SCHEMBL28809774 0.77 CPB1 (0.32) CPB1
SCHEMBL18566553 0.77 JAK2 (0.31) —
SCHEMBL28809728 0.76 ESR2 (0.32) CPB1
SCHEMBL28810413 0.75 CDK5 (0.33) CPB1
SCHEMBL28810610 0.73 MCHR1 (0.35) CPB1
SCHEMBL28810657 0.73 SPR (0.34) CPB1
SCHEMBL28811463 0.66 — —

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-114746090-A Azaindole carboxamide compounds for the treatment of mycobacterial infections 结核病药物开发全球联盟公司 2022-07-12 — — CN disclosed
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