SCHEMBL7142067

SCHEMBL7142067

CN1CCC(C2(O)c3ccccc3CCn3cnnc32)CC1

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.64
SMN1; SMN2 Q16637 1/20 0.64
L3MBTL1 Q9Y468 1/20 0.46
CHRM2 P08172 1/20 0.36
CHRM4 P08173 1/20 0.36
CHRM5 P08912 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36
KDM1A O60341 1/20 0.34
SIGMAR1 Q99720 1/20 0.33
ACHE P22303 1/20 0.33
MEN1 O00255 1/20 0.32
DRD2 P14416 2/20 0.32
DRD1 P21728 2/20 0.32
DRD4 P21917 2/20 0.32
DRD5 P21918 2/20 0.32
DRD3 P35462 2/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32

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
SCHEMBL7177984 0.81 MAPK1 (0.64) MAPK1SMN1; SMN2L3MBTL1CHRM2CHRM4
SCHEMBL7176890 0.79 MAPK1 (0.61) MAPK1SMN1; SMN2L3MBTL1CHRM2CHRM4
SCHEMBL6988444 0.77 SMN1; SMN2 (0.58) MAPK1SMN1; SMN2L3MBTL1CHRM2CHRM4
SCHEMBL11204393 0.77 MAPK1 (0.68) MAPK1SMN1; SMN2L3MBTL1CHRM2CHRM4
SCHEMBL7140590 0.77 SMN1; SMN2 (0.57) MAPK1SMN1; SMN2L3MBTL1CHRM2CHRM4
SCHEMBL7140581 0.74 MAPK1 (0.48) MAPK1SMN1; SMN2L3MBTL1CHRM2CHRM4
SCHEMBL13921299 0.73 MAPK1 (0.82) MAPK1SMN1; SMN2L3MBTL1CHRM2CHRM4
SCHEMBL8709456 0.72 MAPK1 (0.72) MAPK1SMN1; SMN2L3MBTL1CHRM2CHRM4
SCHEMBL9631976 0.72 MAPK1 (0.73) MAPK1SMN1; SMN2L3MBTL1CHRM2CHRM4
SCHEMBL9039655 0.71 MAPK1 (0.72) MAPK1SMN1; SMN2L3MBTL1CHRM2CHRM4

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
EP-0675887-B1 ANTIALLERGIC TRIAZOLOBENZAZEPINE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2003-04-02 EP disclosed