SCHEMBL28205352

SCHEMBL28205352

CN(CCN1CCC(OC(=O)Nc2ccccc2-c2ccccc2)CC1)C(=O)c1ccc(CN2C[C@H]3C[C@@H](C(=O)O)C[C@H]3C2)cc1

nearest known ligand 0.77

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.77
CHRM3 P20309 19/20 0.56
ADRB2 P07550 1/20 0.55

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
SCHEMBL28204778 1.00 CHRM2 (0.77) CHRM2CHRM3ADRB2
SCHEMBL28204774 1.00 CHRM2 (0.77) CHRM2CHRM3ADRB2
SCHEMBL31221643 0.92 CHRM2 (0.88) CHRM2CHRM3ADRB2
SCHEMBL942211 0.92 CHRM2 (0.88) CHRM2CHRM3ADRB2
SCHEMBL943273 0.89 CHRM2 (0.85) CHRM2CHRM3ADRB2
SCHEMBL643486 0.88 CHRM2 (0.77) CHRM2CHRM3ADRB2
SCHEMBL24274186 0.88 CHRM2 (0.87) CHRM2CHRM3ADRB2
SCHEMBL10015122 0.88 CHRM2 (0.87) CHRM2CHRM3ADRB2
SCHEMBL19154410 0.88 CHRM2 (0.84) CHRM2CHRM3ADRB2
SCHEMBL942926 0.88 CHRM2 (0.84) CHRM2CHRM3ADRB2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107849047-B Biphenyl derivative, preparation method and medical application thereof 四川海思科制药有限公司 2021-01-15 CN disclosed
CN-107849047-A Biphenyl derivative, preparation method and medical application thereof 四川海思科制药有限公司 2018-03-27 CN disclosed