SCHEMBL8305632

SCHEMBL8305632

Clc1ccc([C@]2(OCc3ccccc3)CCNC[C@H]2OCc2ccc(Cl)c(Cl)c2)cc1

nearest known ligand 0.48

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
SLC6A3 Q01959 1/20 0.40

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
SCHEMBL6096075 1.00 SLC6A2 (0.40) SLC6A2SLC6A4SLC6A3
SCHEMBL6094493 1.00 SLC6A2 (0.40) SLC6A2SLC6A4SLC6A3
SCHEMBL6094486 1.00 SLC6A2 (0.40) SLC6A2SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL6095493 0.99 SLC6A2 (0.39) SLC6A2SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL6095499 0.99 SLC6A2 (0.39) SLC6A2SLC6A4SLC6A3
SCHEMBL6094541 0.93 HTR2C (0.39) SLC6A4
SCHEMBL6094537 0.93 HTR2C (0.39) SLC6A4
SCHEMBL6095503 0.93 HTR2C (0.39) SLC6A4
SCHEMBL6096043 0.91 SLC6A4 (0.36) SLC6A2SLC6A4SLC6A3
SCHEMBL6097971 0.91 SLC6A4 (0.39) SLC6A2SLC6A4SLC6A3

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
WO-2004080460-A1 SUBSTITUTED PIPERIDINES AS NOVEL MDM2-p53 INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2004-09-23 WO disclosed