SCHEMBL4736385

SCHEMBL4736385

COC(=O)C(C)(c1ccccc1)N1CCCC1

nearest known ligand 0.63

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 18/20 0.63
KCNN4 O15554 1/20 0.51
CYP2B6 P20813 1/20 0.50

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
SCHEMBL2126929 0.98 CHRM3 (0.61) CHRM3KCNN4CYP2B6
SCHEMBL2127682 0.98 CHRM3 (0.61) CHRM3KCNN4CYP2B6
SCHEMBL2014133 0.98 CHRM3 (0.61) CHRM3KCNN4CYP2B6
SCHEMBL1682974 0.98 CHRM3 (0.61) CHRM3KCNN4CYP2B6
SCHEMBL3053742 0.92 CHRM3 (0.58) CHRM3KCNN4CYP2B6
SCHEMBL2128020 0.86 SMN1; SMN2 (0.52) CHRM3KCNN4
SCHEMBL2126812 0.86 CHRM3 (0.62) CHRM3KCNN4
SCHEMBL4736843 0.85 CHRM3 (0.66) CHRM3KCNN4
SCHEMBL4847372 0.84 CHRM3 (0.64) CHRM3KCNN4
SCHEMBL4738208 0.83 CHRM3 (0.62) CHRM3

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
WO-2008075006-A1 PIPERLDINUM COMPOUNDS FOR TREATMENT OF OBSTRUCTIVE PULMONARY DISEASES ( COPD) ASTRAZENECA AB (SE) 2008-06-26 WO disclosed
WO-2008075006-A1 PIPERLDINUM COMPOUNDS FOR TREATMENT OF OBSTRUCTIVE PULMONARY DISEASES ( COPD) ASTRAZENECA AB (SE) 2008-06-26 WO disclosed