SCHEMBL11596303

SCHEMBL11596303

C1CCC(CN2CCN(CC3CCCCC3)CC2)CC1

nearest known ligand 0.84

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 2/20 0.84
ADRA2C P18825 1/20 0.84
ACHE P22303 1/20 0.70
SMN1; SMN2 Q16637 1/20 0.53
CHRM2 P08172 1/20 0.52
CHRM4 P08173 1/20 0.52
CHRM1 P11229 1/20 0.52
CASP1 P29466 1/20 0.50
CASP4 P49662 1/20 0.50
CASP5 P51878 1/20 0.50
OPRM1 P35372 3/20 0.46
OPRL1 P41146 3/20 0.46
OPRD1 P41143 1/20 0.46
OPRK1 P41145 1/20 0.46
TRPC5 Q9UL62 1/20 0.44
SIGMAR1 Q99720 2/20 0.43

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
SCHEMBL5376134 1.00 CHRM5 (0.84) CHRM5ADRA2CACHESMN1; SMN2CHRM2
SCHEMBL3439903 0.92 CHRM5 (0.90) CHRM5ADRA2CACHESMN1; SMN2CHRM2
SCHEMBL1515104 0.92 CHRM5 (1.00) CHRM5ADRA2CACHESMN1; SMN2CHRM2
SCHEMBL18361231 0.92 CHRM5 (1.00) CHRM5ADRA2CACHESMN1; SMN2CHRM2
SCHEMBL30340995 0.92 CHRM5 (1.00) CHRM5ADRA2CACHESMN1; SMN2CHRM2
SCHEMBL3439882 0.92 CHRM5 (1.00) CHRM5ADRA2CACHESMN1; SMN2CHRM2
SCHEMBL19575409 0.92 CHRM5 (1.00) CHRM5ADRA2CACHESMN1; SMN2CHRM2
SCHEMBL18616997 0.92 CHRM5 (1.00) CHRM5ADRA2CACHESMN1; SMN2CHRM2
SCHEMBL20643257 0.92 CHRM5 (1.00) CHRM5ADRA2CACHESMN1; SMN2CHRM2
Leptacline SCHEMBL509769 0.92 CHRM5 (1.00) CHRM5ADRA2CACHESMN1; SMN2CHRM2

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-4126467-A POLYMER HAVING REPEATING PIPERAZING-CONTAINING UNITS FUJI PHOTO FILM CO., LTD. (JP) 1978-11-21 US disclosed