SCHEMBL8691887

SCHEMBL8691887

CC(Oc1cccc(Cl)c1)C1CC(C(C)(C)N)CCN1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 13/20 0.42
SLC6A2 P23975 2/20 0.38
SLC6A4 P31645 2/20 0.38
SLC6A3 Q01959 2/20 0.38
CYP2D6 P10635 1/20 0.38
OGG1 O15527 1/20 0.38

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
Hydrochloric Acid SCHEMBL8693010 0.99 GHSR (0.42) GHSRSLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL8692200 0.86 SLC6A2 (0.37) GHSRSLC6A2SLC6A4SLC6A3
SCHEMBL8690688 0.75 GHSR (0.41) GHSR
Hydrochloric Acid SCHEMBL8691256 0.74 GHSR (0.41) GHSR
SCHEMBL22372831 0.66 GHSR (0.48) GHSRSLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL521398 0.65 SLC6A3 (0.43) GHSRSLC6A2SLC6A4SLC6A3
SCHEMBL4961425 0.65 CHRNB2 (0.46)
SCHEMBL14131571 0.65 CHRNB2 (0.46)
SCHEMBL4961430 0.65 CHRNB2 (0.46)
Chloromethane SCHEMBL27541396 0.65 OGG1 (0.56) SLC6A2SLC6A4SLC6A3CYP2D6OGG1

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-5760035-A PIPERIDINE COMPOUNDS SUBSTITUTED WITH AN AMINOALKYL GROUP AND AN ARYLOXYALKYL GROUP, ANTIALLERGENS, ANTIINFLAMMATORY AGENTS, IMMUNOSUPPRESSANTS KNOLL AKTIENGESELLSCHAFT (DE) 1998-06-02 US disclosed