SCHEMBL29244684

SCHEMBL29244684

NC(=O)OC1CCC2CNCC21

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 2/20 0.40
CHRNB2 P17787 4/20 0.37
CHRNB4 P30926 4/20 0.37
CHRNA3 P32297 4/20 0.37
CHRNA4 P43681 4/20 0.37
CHRNA7 P36544 3/20 0.37

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
SCHEMBL28695398 0.89 CHRNB2 (0.35) IRAK4CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL15880092 0.79 CHRNB2 (0.32) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL15880093 0.79 CHRNB2 (0.32) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL22235569 0.76 CHRNB2 (0.42) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL23015201 0.74 SSTR4 (0.36) IRAK4CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL26099348 0.71 ATM (0.32) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL21144296 0.71 ATM (0.32) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL26099346 0.71 ATM (0.32) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL19063554 0.71 PPM1D (0.30)
SCHEMBL22410580 0.71 CHRNB2 (0.41) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7

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
CN-118239959-A Cyclopropane TLR7 and 8 inhibitor and preparation method and application thereof 上海深势唯思科技有限责任公司 2024-06-25 CN disclosed
CN-118239926-A TLR7 and 8 inhibitors, preparation method and application thereof 上海深势唯思科技有限责任公司 2024-06-25 CN disclosed