SCHEMBL14623596

SCHEMBL14623596

CC(C)C(=O)NC1CCc2[nH]c3c(Cl)cc(N)cc3c2C1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR1B P28222 3/20 0.41
HTR1A P08908 2/20 0.41
HTR1D P28221 1/20 0.41
MTNR1A P48039 1/20 0.41
MTNR1B P49286 1/20 0.41
DRD2 P14416 1/20 0.37
DRD4 P21917 1/20 0.37
HTR1E P28566 1/20 0.37
HTR7 P34969 1/20 0.37
OPRM1 P35372 1/20 0.37
TMEM97 Q5BJF2 1/20 0.37
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CGAS Q8N884 1/20 0.33
JAK2 O60674 1/20 0.33
JAK1 P23458 1/20 0.33
TYK2 P29597 1/20 0.33
JAK3 P52333 1/20 0.33

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
SCHEMBL1881308 0.85 MTNR1A (0.40) HTR1BHTR1AHTR1DMTNR1AMTNR1B
SCHEMBL14624164 0.82 HTR1B (0.47) HTR1BHTR1AHTR1DMTNR1AMTNR1B
SCHEMBL14624578 0.81 HTR1B (0.56) HTR1BHTR1AHTR1DMTNR1AMTNR1B
SCHEMBL1880746 0.79 HTR1B (0.43) HTR1BHTR1AHTR1DMTNR1AMTNR1B
SCHEMBL7415604 0.78 MTNR1A (0.42) HTR1BHTR1AHTR1DMTNR1AMTNR1B
SCHEMBL1875313 0.77 HTR1A (0.54) HTR1BHTR1AHTR1DDRD2DRD4
SCHEMBL1879389 0.77 MTNR1A (0.41) HTR1BHTR1AHTR1DMTNR1AMTNR1B
SCHEMBL7415569 0.77 CGAS (0.45) HTR1BHTR1AHTR1DMTNR1AMTNR1B
SCHEMBL14624157 0.75 HTR1B (0.48) HTR1BHTR1AHTR1DMTNR1AMTNR1B
SCHEMBL13478774 0.73 MTNR1A (0.44) HTR1BHTR1AHTR1DMTNR1AMTNR1B

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-2007002181-A2 TETRAHYDROCARBAZOLE DERIVATIVES USEFUL AS ANDROGEN RECEPTOR MODULATORS (SARM) ELI LILLY AND COMPANY (US) 2007-01-04 WO disclosed