SCHEMBL27365901

SCHEMBL27365901

CN(CCc1cccc2ccc(O)cc12)C1CC1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 5/20 0.61
MTNR1A P48039 4/20 0.50
MTNR1B P49286 3/20 0.50
MCL1 Q07820 1/20 0.47
NQO2 P16083 3/20 0.44
DRD2 P14416 1/20 0.39
DRD4 P21917 1/20 0.39
DRD3 P35462 1/20 0.39
HTR1A P08908 1/20 0.38
HTR2C P28335 1/20 0.38
SLC6A4 P31645 1/20 0.38
TRPV1 Q8NER1 1/20 0.38

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
SCHEMBL27367140 0.84 HTR2A (0.54) HTR2AMTNR1AMTNR1BHTR1AHTR2C
SCHEMBL27366117 0.84 HTR2A (0.54) HTR2AMTNR1AMTNR1B
SCHEMBL28788751 0.83 HTR2A (0.64) HTR2AMTNR1AMTNR1BMCL1NQO2
SCHEMBL27365899 0.82 HTR2A (0.71) HTR2AMTNR1AMTNR1BNQO2HTR2C
SCHEMBL27365895 0.78 HTR2A (0.59) HTR2AMTNR1AMTNR1BMCL1NQO2
Fumaric Acid SCHEMBL31331964 0.78 HTR2A (0.48) HTR2AMTNR1AMTNR1BHTR1AHTR2C
Hydrochloric Acid SCHEMBL31332043 0.77 HTR2A (0.58) HTR2AMTNR1AMTNR1BMCL1NQO2
SCHEMBL27366108 0.76 HTR2A (1.00) HTR2ADRD2DRD3HTR1AHTR2C
Fumaric Acid SCHEMBL31332068 0.76 MTNR1A (0.62) HTR2AMTNR1AMTNR1BNQO2HTR2C
SCHEMBL14714354 0.71 MTNR1A (0.57) MTNR1AMTNR1BMCL1NQO2TRPV1

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
CN-119384406-A Compounds of formula (I) 赛洛私人有限公司 2025-01-28 CN disclosed
WO-2023230649-A1 COMPOUNDS Psylo Pty Ltd (AU) 2023-12-07 WO disclosed