SCHEMBL28098524

SCHEMBL28098524

CN(C(=O)CCN1CCC(OC(=O)NNc2ccccc2-c2ccccc2)CC1)c1cccc(C(=O)Cl)c1

nearest known ligand 0.50

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 20/20 0.50
ADRB2 P07550 16/20 0.49

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
SCHEMBL693175 0.92 CHRM3 (0.61) CHRM3ADRB2
SCHEMBL693763 0.85 CHRM3 (0.62) CHRM3ADRB2
SCHEMBL694508 0.84 CHRM3 (0.61) CHRM3ADRB2
SCHEMBL19215591 0.84 CHRM3 (0.61) CHRM3
SCHEMBL17928444 0.82 CHRM3 (0.65) CHRM3
SCHEMBL19215605 0.80 CHRM3 (0.64) CHRM3ADRB2
SCHEMBL19215596 0.80 CHRM3 (0.62) CHRM3ADRB2
SCHEMBL19215607 0.79 CHRM3 (0.64) CHRM3ADRB2
SCHEMBL694633 0.79 CHRM3 (0.64) CHRM3ADRB2
SCHEMBL19215592 0.78 CHRM3 (0.59) CHRM3ADRB2

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-103936716-B Tool muscarinic receptor antagonists and the diamide compound of beta 2 adrenoreceptor agonists activity 施万呼吸有限责任公司 2016-09-07 CN disclosed