SCHEMBL8302958

SCHEMBL8302958

OC(CCN1CCN(c2cccc3[nH]ccc23)CC1)c1csc2ccccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 13/20 0.74
HTR1D P28221 1/20 0.65
HTR7 P34969 2/20 0.57

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 SCHEMBL6597536 0.99 HTR1A (0.73) HTR1AHTR1DHTR7
SCHEMBL6596051 0.88 HTR1A (0.66) HTR1AHTR1D
SCHEMBL6598257 0.84 HTR7 (0.57) HTR1AHTR1DHTR7
SCHEMBL6598942 0.82 HTR1A (1.00) HTR1AHTR1DHTR7
SCHEMBL6598787 0.82 HTR1A (0.67) HTR1AHTR1DHTR7
SCHEMBL6597158 0.80 HTR1A (1.00) HTR1AHTR1DHTR7
SCHEMBL29708061 0.79 HTR1A (1.00) HTR1AHTR1D
SCHEMBL6597327 0.79 HTR1A (1.00) HTR1AHTR1D
SCHEMBL6598440 0.78 HTR1A (0.74) HTR1AHTR1DHTR7
Hydrochloric Acid SCHEMBL6598848 0.77 HTR1A (0.87) HTR1AHTR1DHTR7

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-2004082686-A2 USE OF COMPOUNDS WITH COMBINED 5-HT1A AND SSRI ACTIVITIES TO TREAT SEXUAL DYSFUNCTION DYNOGEN PHARMACEUTICALS, INC. (US) 2004-09-30 WO disclosed