SCHEMBL9528610

SCHEMBL9528610

CC1(O)CCN2CC=C(c3ccccc3)C1C2

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 2/20 0.35
CHRM2 P08172 12/20 0.35
CHRM4 P08173 12/20 0.35
CHRM5 P08912 12/20 0.35
CHRM1 P11229 12/20 0.35
CHRM3 P20309 12/20 0.35
TRPA1 O75762 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
SCHEMBL9528907 0.86 SLC18A3 (0.34) SLC18A3
SCHEMBL9531460 0.67 CHRNA7 (0.40) SLC18A3CHRM2CHRM4CHRM5CHRM1
Hydrochloric Acid SCHEMBL9530432 0.66 CHRNA7 (0.39) SLC18A3CHRM2CHRM4CHRM5CHRM1
SCHEMBL9532190 0.65 CHRM2 (0.37) SLC18A3CHRM2CHRM4CHRM5CHRM1
SCHEMBL9529438 0.64 CHRM2 (0.37) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL1724390 0.63 KDM1A (0.50) SLC18A3TRPA1
SCHEMBL5542453 0.62 SLC6A2 (0.47)
SCHEMBL28020963 0.60 TRPA1 (0.54) SLC18A3TRPA1
SCHEMBL2640738 0.60 KDM1A (0.61) TRPA1
SCHEMBL28766998 0.59 SLC18A3 (0.55) SLC18A3TRPA1

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
EP-0556342-A1 NEW 1-AZABICYCLOALKANE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESS FOR PREPARING SAME GYOGYSZERKUTATO INTEZET K.V. (HU) 1993-08-25 EP disclosed
WO-1992007854-A1 NEW 1-AZABICYCLOALKANE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESS FOR PREPARING SAME GYÓGYSZERKUTATÓ INTÉZET KV. (HU) 1992-05-14 WO disclosed