SCHEMBL9704974

SCHEMBL9704974

COCc1noc(C2=CCCN(OC(=O)C(=O)ON3CCC=C(c4nc(COC)no4)C3)C2)n1

nearest known ligand 0.69

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 17/20 0.69
CHRM4 P08173 17/20 0.69
CHRM5 P08912 17/20 0.69
CHRM1 P11229 17/20 0.69
CHRM3 P20309 17/20 0.69

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
SCHEMBL10419461 0.88 CHRM2 (0.54) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL9704156 0.86 CHRM2 (0.67) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL9702311 0.84 CHRM2 (0.68) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL10420361 0.82 CHRM2 (0.63) CHRM2CHRM4CHRM5CHRM1CHRM3
Oxalic Acid SCHEMBL9702754 0.81 CHRM2 (1.00) CHRM2CHRM4CHRM5CHRM1CHRM3
Oxalic Acid SCHEMBL9702747 0.81 CHRM2 (1.00) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL9703153 0.80 CHRM2 (1.00) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL9702340 0.79 CHRM2 (0.44) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL9404481 0.77 CHRM1 (0.41) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL9704120 0.76 CHRM2 (0.45) CHRM2CHRM4CHRM5CHRM1CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0259621-B1 PIPERIDINE COMPOUNDS AND THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1992-11-25 EP disclosed
US-4933353-A ALZHEIMER*S DISEASE A/S FERROSAN (DE) 1990-06-12 US disclosed
US-4837241-A TREATMENT OF ALZEHEIMER*S DISEASE A/S FERROSAN (DK) 1989-06-06 US disclosed