SCHEMBL21389399

SCHEMBL21389399

C[C@@H]1CC[C@H](C)C(=O)N1CCN

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 1/20 0.34
▸ CHRM2 P08172 4/20 0.33
▸ CHRM4 P08173 4/20 0.33
▸ CHRM5 P08912 4/20 0.33
▸ CHRM1 P11229 4/20 0.33
▸ CHRM3 P20309 4/20 0.33

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
SCHEMBL5331770 0.78 CHRM2 (0.47) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL21383933 0.71 PIK3CD (0.56) PIK3CDCHRM2CHRM4CHRM5CHRM1
SCHEMBL25141200 0.69 — —
SCHEMBL24796057 0.68 SMN1; SMN2 (0.32) —
SCHEMBL1857037 0.68 CHRM2 (0.45) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL21384273 0.68 PIK3CD (0.44) PIK3CDCHRM2CHRM4CHRM5CHRM1
SCHEMBL21389514 0.68 PIK3CD (0.44) PIK3CDCHRM2CHRM4CHRM5CHRM1
SCHEMBL30131248 0.68 PIK3CD (0.44) PIK3CDCHRM2CHRM4CHRM5CHRM1
SCHEMBL21384274 0.68 PIK3CD (0.44) PIK3CDCHRM2CHRM4CHRM5CHRM1
SCHEMBL24796176 0.67 CHRM2 (0.46) PIK3CDCHRM2CHRM4CHRM5CHRM1

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-2019183577-A1 MODULATORS OF G-PROTEIN COUPLED RECEPTORS CARMOT THERAPEUTICS, INC. (US) 2019-09-26 — — WO disclosed
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