SCHEMBL8877925

SCHEMBL8877925

COc1ccc2c(C3CCN(CCCN)CC3)c[nH]c2c1

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SLC6A4 P31645 12/20 0.60
▸ HTR1A P08908 10/20 0.56
▸ DRD2 P14416 7/20 0.56
▸ HTR7 P34969 6/20 0.56
▸ HTR6 P50406 6/20 0.56
▸ HTR2A P28223 5/20 0.56
▸ ADRA1D P25100 2/20 0.55

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
SCHEMBL8880695 0.91 SLC6A4 (0.67) SLC6A4HTR1ADRD2HTR7HTR6
Hydrochloric Acid SCHEMBL7259914 0.88 ADRA1D (0.71) SLC6A4HTR1ADRD2HTR7HTR6
SCHEMBL25758273 0.84 SLC6A4 (0.66) SLC6A4HTR1ADRD2HTR7HTR6
SCHEMBL8876794 0.83 SLC6A4 (0.64) SLC6A4DRD2ADRA1D
SCHEMBL8877539 0.83 ADRA1D (0.79) SLC6A4HTR1ADRD2HTR7HTR6
SCHEMBL8879616 0.82 SLC6A4 (0.55) SLC6A4DRD2HTR7HTR2AADRA1D
Hydrochloric Acid SCHEMBL7259917 0.80 ADRA1D (0.51) SLC6A4HTR1ADRD2HTR7HTR6
SCHEMBL8820411 0.80 SLC6A4 (0.60) SLC6A4HTR1ADRD2HTR7HTR6
SCHEMBL8876449 0.80 SLC6A4 (0.60) SLC6A4DRD2ADRA1D
SCHEMBL8879141 0.80 SLC6A4 (0.60) SLC6A4DRD2ADRA1D

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
US-5670511-A Indolepiperidine derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1997-09-23 — — US disclosed
EP-0722942-A1 Indole piperidine derivatives MERCK PATENT GmbH (DE) 1996-07-24 — — EP disclosed
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