SCHEMBL27997201

SCHEMBL27997201

OCC1(c2ccc(Cl)c(Cl)c2)CCC1

nearest known ligand 0.74

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 20/20 0.74
SLC6A2 P23975 14/20 0.74
SLC6A3 Q01959 18/20 0.69
CYP2D6 P10635 1/20 0.56

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
SCHEMBL15862815 0.96 SLC6A4 (0.74) SLC6A4SLC6A2SLC6A3CYP2D6
SCHEMBL10878340 0.92 SLC6A4 (0.69) SLC6A4SLC6A2SLC6A3
SCHEMBL14314489 0.86 SLC6A4 (1.00) SLC6A4SLC6A2SLC6A3CYP2D6
SCHEMBL3467709 0.82 SLC6A4 (0.80) SLC6A4SLC6A2SLC6A3CYP2D6
SCHEMBL3467707 0.82 SLC6A4 (0.80) SLC6A4SLC6A2SLC6A3CYP2D6
SCHEMBL1566412 0.82 SLC6A4 (0.74) SLC6A4SLC6A2SLC6A3CYP2D6
SCHEMBL6169426 0.82 SLC6A4 (0.58) SLC6A4SLC6A2SLC6A3
SCHEMBL3518627 0.81 SLC6A3 (1.00) SLC6A4SLC6A2SLC6A3
SCHEMBL14314490 0.81 SLC6A4 (0.80) SLC6A4SLC6A2SLC6A3CYP2D6
SCHEMBL5085593 0.81 SLC6A4 (0.72) SLC6A4SLC6A2SLC6A3CYP2D6

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
CN-104254522-A Methanol derivatives as trpv3 modulators ABBVIE INC 2014-12-31 CN disclosed