SCHEMBL24955562

SCHEMBL24955562

CN1CCC2CCOCC21

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 2/20 0.33
L3MBTL3 Q96JM7 1/20 0.32
CHRNB4 P30926 2/20 0.31
CHRNA3 P32297 2/20 0.31
CHRNB2 P17787 1/20 0.31
CHRNA4 P43681 1/20 0.31
PIK3C3 Q8NEB9 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
SCHEMBL19275744 0.84 PIK3C3 (0.36) CHRM2CHRNB4CHRNA3CHRNB2CHRNA4
SCHEMBL15849329 0.83 L3MBTL3 (0.35) L3MBTL3
SCHEMBL12628888 0.82
SCHEMBL12628852 0.82
SCHEMBL12628881 0.82
SCHEMBL16432708 0.81 PIK3C3 (0.33) CHRM2CHRNB4CHRNA3CHRNB2CHRNA4
SCHEMBL29605672 0.81 PIK3C3 (0.33) CHRM2CHRNB4CHRNA3CHRNB2CHRNA4
SCHEMBL3022699 0.79 PIK3C3 (0.36) CHRNB4CHRNA3CHRNB2CHRNA4PIK3C3
SCHEMBL14968843 0.76 PIK3C3 (0.35) PIK3C3
SCHEMBL18818520 0.75 L3MBTL3 (0.40) CHRM2L3MBTL3CHRNB4CHRNA3CHRNB2

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-2023007185-A1 IMIDAZOLE ORGANIC COMPOUNDS AND THEIR USE AGAINST INFLAMMATORY BOWEL DISEASE Benevolentai Cambridge Limited (GB) 2023-02-02 WO disclosed