SCHEMBL7365317

SCHEMBL7365317

CCC1(N2CCN(c3noc4cc(F)ccc34)CC2)CNC(=O)N1C(C)C

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 15/20 0.49
DRD2 P14416 10/20 0.49
HTR7 P34969 9/20 0.49
KCNH2 Q12809 6/20 0.48
HTR1A P08908 3/20 0.43
SLC6A4 P31645 1/20 0.36
HTR2C P28335 2/20 0.35

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
SCHEMBL7367058 0.89 HTR2A (0.48) HTR2ADRD2HTR7KCNH2HTR1A
SCHEMBL7367430 0.83 DRD2 (0.55) HTR2ADRD2HTR7KCNH2HTR1A
SCHEMBL13448255 0.72 HTR2A (0.60) HTR2ADRD2HTR7KCNH2HTR1A
SCHEMBL7368732 0.72 DRD2 (0.52) HTR2ADRD2HTR7KCNH2HTR1A
SCHEMBL22302778 0.70 DRD2 (0.63) HTR2ADRD2HTR7KCNH2HTR1A
SCHEMBL7365704 0.70 DRD2 (0.55) HTR2ADRD2HTR7KCNH2HTR1A
SCHEMBL8113109 0.70 HTR2A (0.55) HTR2ADRD2HTR7KCNH2HTR1A
SCHEMBL8113389 0.69 HTR2A (0.57) HTR2ADRD2HTR7KCNH2HTR1A
SCHEMBL7365322 0.69 HTR2A (0.48) HTR2ADRD2HTR7KCNH2HTR1A
SCHEMBL7360768 0.69 DRD2 (0.52) HTR2ADRD2HTR7KCNH2SLC6A4

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-5780474-A ADMINISTERING IN THE TREATMENT OF PSYCHOTIC DISORDERS, ANXIO-DEPRESSIVE DISORDERS AND AGGRESSIVENESS ADIR ET COMPAGNIE (FR) 1998-07-14 US claimed
US-5780474-A ADMINISTERING IN THE TREATMENT OF PSYCHOTIC DISORDERS, ANXIO-DEPRESSIVE DISORDERS AND AGGRESSIVENESS ADIR ET COMPAGNIE (FR) 1998-07-14 US disclosed