SCHEMBL31377463

SCHEMBL31377463

CC(C1CNc2ccccc21)N(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2B P18089 6/20 0.32
ADRA2C P18825 6/20 0.32
ADRA2A P08913 5/20 0.32
HTR1A P08908 2/20 0.32
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
KMT2A Q03164 1/20 0.32
TACR1 P25103 1/20 0.31
HTR5A P47898 1/20 0.31
PRCP P42785 1/20 0.31
MTNR1A P48039 1/20 0.31
MTNR1B P49286 1/20 0.31
CHRM1 P11229 1/20 0.30
DRD2 P14416 1/20 0.30
CHRM3 P20309 1/20 0.30
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
ADRA1A P35348 1/20 0.30
HRH1 P35367 1/20 0.30
DRD3 P35462 1/20 0.30

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
SCHEMBL1615464 0.82 PRCP (0.38) MEN1GAAKMT2APRCPHTR2A
SCHEMBL8649620 0.79 PAX8 (0.31) PAX8
SCHEMBL9821731 0.79 MEN1 (0.37) MEN1GAAKMT2ATACR1PRCP
SCHEMBL18792440 0.79 MEN1 (0.33) MEN1GAAKMT2APRCPHTR2A
SCHEMBL18886228 0.79 MEN1 (0.33) MEN1GAAKMT2APRCPHTR2A
SCHEMBL21140586 0.71 SLC6A2 (0.39)
SCHEMBL23372989 0.70 HTR2A (0.32) ADRA2CADRA2AHTR2A
SCHEMBL22603159 0.70 CYP1A2 (0.38) MTNR1AMTNR1B
SCHEMBL18886131 0.68 AR (0.40) ADRA2BADRA2CADRA2AHTR1APRCP
SCHEMBL13059131 0.68 AR (0.40) ADRA2BADRA2CADRA2AHTR1APRCP

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-119522212-A Indoline derivatives as serotonergic agents for the treatment of related disorders 思维模式制药公司 2025-02-25 CN disclosed