SCHEMBL28535908

SCHEMBL28535908

O=C(OCc1ccccc1)N(Cc1ccccc1)C1CN2CCC1CC2

nearest known ligand 0.71

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CHRM1 P11229 17/20 0.71
▸ CHRM3 P20309 17/20 0.71
▸ CHRM5 P08912 13/20 0.71
▸ CHRM2 P08172 9/20 0.71
▸ SIGMAR1 Q99720 1/20 0.46

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
SCHEMBL28544151 0.88 CHRM1 (0.56) CHRM1CHRM3CHRM5CHRM2
SCHEMBL28536543 0.86 CHRM1 (0.54) CHRM1CHRM3CHRM5CHRM2
SCHEMBL28542085 0.80 CHRM1 (0.49) CHRM1CHRM3CHRM5CHRM2
SCHEMBL14335155 0.77 CHRM1 (0.57) CHRM1CHRM3CHRM5CHRM2SIGMAR1
SCHEMBL14335152 0.77 CHRM1 (0.57) CHRM1CHRM3CHRM5CHRM2SIGMAR1
SCHEMBL3355641 0.77 HTR2A (0.54) CHRM1CHRM3CHRM5CHRM2SIGMAR1
SCHEMBL3341171 0.76 SLC18A3 (0.55) CHRM1CHRM3CHRM5CHRM2SIGMAR1
SCHEMBL743904 0.76 CHRM2 (0.44) CHRM1CHRM3CHRM5CHRM2SIGMAR1
SCHEMBL4807309 0.76 PTGDR2 (0.46) CHRM1CHRM3CHRM5CHRM2SIGMAR1
SCHEMBL4807302 0.76 PTGDR2 (0.46) CHRM1CHRM3CHRM5CHRM2SIGMAR1

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-107080747-B Glucosylceramide synthase inhibitors 建新公司 2021-02-26 — — CN disclosed
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