SCHEMBL6599536

SCHEMBL6599536

OC(CCN1CCN(c2ccc(Cl)cc2)CC1)c1csc2ccccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 14/20 1.00
HTR7 P34969 3/20 0.76
HTR1D P28221 1/20 0.63

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 SCHEMBL6599509 0.81 HTR1A (0.98) HTR1AHTR7HTR1D
SCHEMBL6598942 0.81 HTR1A (1.00) HTR1AHTR7HTR1D
SCHEMBL6598834 0.79 HTR1A (1.00) HTR1AHTR7HTR1D
SCHEMBL1578095 0.79 HTR1A (0.66) HTR1AHTR7HTR1D
SCHEMBL6597612 0.79 HTR1A (1.00) HTR1AHTR7HTR1D
SCHEMBL1578116 0.78 HTR1A (0.65) HTR1AHTR7HTR1D
Hydrochloric Acid SCHEMBL1578045 0.78 HTR1A (0.65) HTR1AHTR7HTR1D
SCHEMBL29708061 0.78 HTR1A (1.00) HTR1AHTR1D
SCHEMBL6597327 0.78 HTR1A (1.00) HTR1AHTR1D
Hydrochloric Acid SCHEMBL1578328 0.77 HTR1A (0.64) HTR1AHTR7HTR1D

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1008594-B1 COMPOUNDS DERIVED FROM THOPHENE AND BENZOTHIOPHENE, AND RELATED UTILISATION AND COMPOSITION VITA LAB (ES) 2004-03-17 EP disclosed
US-6262056-B1 TREATING ANXIETY OR DEPRESSION VITA-INVEST, SA (ES) 2001-07-17 US disclosed
EP-1008594-A1 COMPOUNDS DERIVED FROM THOPHENE AND BENZOTHIOPHENE, AND RELATED UTILISATION AND COMPOSITION VITA-INVEST, S.A. (ES) 2000-06-14 EP disclosed