SCHEMBL7902124

SCHEMBL7902124

[CH2]Cc1cn(S(=O)(=O)c2ccccc2)c2ccccc12

nearest known ligand 0.73

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 20/20 0.73
HTR1A P08908 1/20 0.64
DRD2 P14416 1/20 0.64
HTR1D P28221 1/20 0.64
HTR1B P28222 1/20 0.64
HTR1F P30939 1/20 0.64
HTR7 P34969 1/20 0.64
DRD3 P35462 1/20 0.64

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
SCHEMBL946691 0.86 HTR6 (0.75) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL13137678 0.84 HTR6 (0.73) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL946710 0.84 HTR6 (0.73) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL30579484 0.84 HTR6 (0.73) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL16704081 0.82 HTR6 (0.69) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL7894537 0.82 HTR6 (0.74) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL1357126 0.82 HTR6 (1.00) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL8689013 0.81 HTR6 (0.68) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL20542046 0.81 HTR6 (0.68) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL1171841 0.81 HTR6 (1.00) HTR6HTR1ADRD2HTR1DHTR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1993017032-A1 TECHNIQUES AND INTERMEDIATES FOR PREPARING NON-PEPTIDE PEPTIDOMIMETICS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 1993-09-02 WO claimed
US-6197963-B1 TETRAHYDROPYRAN DERIVATIVES; PROTEIN G, SOMATOSTATIN, AND NATURAL KILLER CELL RECEPTOR ANTAGONISTS OR MIMETICS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA 2001-03-06 US disclosed
EP-0728007-A4 NON-PEPTIDE PEPTIDOMIMETICS UNIV PENNSYLVANIA (US) 1998-09-02 EP disclosed
WO-1997028172-A1 NON-PEPTIDE PEPTIDOMIMETICS AND RELATED CYCLIC HEXAPEPTIDES THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 1997-08-07 WO disclosed
EP-0728007-A1 NON-PEPTIDE PEPTIDOMIMETICS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 1996-08-28 EP disclosed
WO-1995011686-A1 NON-PEPTIDE PEPTIDOMIMETICS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 1995-05-04 WO disclosed
WO-1993017032-A1 TECHNIQUES AND INTERMEDIATES FOR PREPARING NON-PEPTIDE PEPTIDOMIMETICS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 1993-09-02 WO disclosed