SCHEMBL23744720

SCHEMBL23744720

CC1CN(C(=O)OC2CC3(C2)CN(Cc2ccccc2)C3)[C@H](C)CN1c1ncc(C(F)(F)F)cn1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 11/20 0.46
CHRM1 P11229 11/20 0.46
CHRM3 P20309 6/20 0.46
CHRM5 P08912 2/20 0.41
GPR119 Q8TDV5 1/20 0.40
CHRM4 P08173 3/20 0.39
USP2 O75604 1/20 0.39
MGLL Q99685 2/20 0.38

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
SCHEMBL26429325 1.00 CHRM2 (0.46) CHRM2CHRM1CHRM3CHRM5GPR119
SCHEMBL26429326 1.00 CHRM2 (0.46) CHRM2CHRM1CHRM3CHRM5GPR119
SCHEMBL26429782 0.93 GPR119 (0.41) CHRM2CHRM1CHRM3CHRM5GPR119
SCHEMBL26429752 0.93 CHRM2 (0.47) CHRM2CHRM1CHRM3CHRM5GPR119
SCHEMBL26429409 0.91 CHRM4 (0.44) CHRM2CHRM1CHRM3CHRM5GPR119
SCHEMBL26429793 0.90 GPR119 (0.53) CHRM2CHRM1CHRM3GPR119CHRM4
SCHEMBL30345592 0.90 GPR119 (0.53) CHRM2CHRM1CHRM3GPR119CHRM4
SCHEMBL26429324 0.89 CHRM2 (0.47) CHRM2CHRM1CHRM3CHRM5GPR119
SCHEMBL26429319 0.88 CHRM1 (0.59) CHRM2CHRM1CHRM3CHRM5CHRM4
SCHEMBL26429304 0.88 CHRM2 (0.45) CHRM2CHRM1CHRM3CHRM5GPR119

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-2021158698-A1 MUSCARINIC RECEPTOR 4 ANTAGONISTS AND METHODS OF USE NEUROCRINE BIOSCIENCES, INC. (US) 2021-08-12 WO disclosed