SCHEMBL28375771

SCHEMBL28375771

CCN(CCc1c[nH]c2cc(OC)ccc12)C(=O)c1cc(C)ccc1-n1nccn1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.48
HCRTR2 O43614 14/20 0.47
HCRTR1 O43613 13/20 0.47
MTNR1A P48039 1/20 0.44
MTNR1B P49286 1/20 0.44
HTR2A P28223 1/20 0.42
HTR1A P08908 1/20 0.42
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41

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
SCHEMBL28370216 0.93 HCRTR2 (0.53) HTR6HCRTR2HCRTR1MTNR1AMTNR1B
SCHEMBL28374107 0.88 HCRTR1 (0.53) HCRTR2HCRTR1HTR1A
SCHEMBL28374151 0.88 HCRTR1 (0.47) HCRTR2HCRTR1
SCHEMBL28375766 0.87 HCRTR1 (0.53) HCRTR2HCRTR1
SCHEMBL28370934 0.83 HCRTR1 (0.53) HCRTR2HCRTR1HTR2A
SCHEMBL28370736 0.83 HCRTR1 (0.47) HTR6HCRTR2HCRTR1MTNR1AMTNR1B
SCHEMBL28370643 0.82 MTNR1A (0.58) HCRTR2MTNR1AMTNR1BHTR1AKMT2A
SCHEMBL28374897 0.79 HCRTR1 (0.49) HTR6HCRTR2HCRTR1
SCHEMBL28374485 0.77 HCRTR1 (0.49) HTR6HCRTR2HCRTR1MTNR1A
SCHEMBL15338611 0.75 HCRTR1 (0.62) HCRTR2HCRTR1

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
CN-106986859-B Indole derivatives and uses thereof 广东东阳光药业有限公司 2020-02-11 CN disclosed