SCHEMBL25955713

SCHEMBL25955713

CC(=O)N(C)CCC(C(C)C)C(C)C

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CHRM1 P11229 2/20 0.35
▸ CHRNB2 P17787 1/20 0.31
▸ CHRNB4 P30926 1/20 0.31
▸ CHRNA3 P32297 1/20 0.31
▸ CHRNA4 P43681 1/20 0.31
▸ CHRM2 P08172 1/20 0.31
▸ CHRM4 P08173 1/20 0.31
▸ CHRM5 P08912 1/20 0.31
▸ CHRM3 P20309 1/20 0.31
▸ 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
SCHEMBL12384299 0.81 ALDH1A1 (0.38) CHRM1CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL12633371 0.77 GABRP (0.43) CHRM1CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL13770949 0.77 CHRNB2 (0.46) CHRM1CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL22912887 0.76 USP2 (0.36) CHRM1CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL7942491 0.74 CHRM1 (0.48) CHRM1CHRNB2CHRNA4CHRM2CHRM4
SCHEMBL6753704 0.74 CHRM1 (0.38) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL13780656 0.74 ALDH1A1 (0.38) CHRM1CHRNB2CHRNA4
SCHEMBL23153529 0.73 CHRM1 (0.35) CHRM1
SCHEMBL17789614 0.73 NOS3 (0.39) CHRM1CHRNB2CHRNB4CHRNA4USP2
SCHEMBL14280513 0.72 CHRM1 (0.32) CHRM1

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
EP-4223753-A1 AROYL SUBSTITUTED TRICYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF Genfleet Therapeutics (Shanghai) Inc. (CN) 2023-08-09 — — EP disclosed
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