SCHEMBL4483296

SCHEMBL4483296

O=C(CCN1CCC(OC(=O)N(c2ccccc2-c2ccccc2)c2ccccc2-c2ccccc2)CC1)Nc1cccc(C(=O)NCCNCc2ccc(O)cc2)c1

nearest known ligand 0.45

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 20/20 0.45
ADRB2 P07550 19/20 0.45

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
SCHEMBL4475461 0.94 CHRM3 (0.46) CHRM3ADRB2
SCHEMBL4483286 0.93 CHRM3 (0.42) CHRM3ADRB2
SCHEMBL4482057 0.91 CHRM3 (0.48) CHRM3ADRB2
SCHEMBL4493225 0.90 CHRM3 (0.46) CHRM3ADRB2
SCHEMBL268046 0.90 CHRM3 (0.54) CHRM3ADRB2
SCHEMBL4490821 0.89 CHRM3 (0.43) CHRM3ADRB2
SCHEMBL4489058 0.88 ADRB2 (0.45) CHRM3ADRB2
SCHEMBL4475453 0.88 CHRM3 (0.43) CHRM3ADRB2
SCHEMBL4478639 0.88 CHRM3 (0.41) CHRM3ADRB2
SCHEMBL4478362 0.87 CHRM3 (0.42) 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
US-7632847-B2 Bronchodilators; treating chronic obstructive pulmonary disease or asthma; long duration of action; reduced side effects, such as dry-mouth and constipation; e.g. biphenyl-2-ylcarbamic acid 1-(2-(3-[3-(4-hydroxybenzylamino)propionylamino]benzoylamino)ethyl)piperidin-4-yl ester THERAVANCE, INC. (US) 2009-12-15 US disclosed