SCHEMBL31666417

SCHEMBL31666417

CCN(C)CCc1c[nH]c2cccc(OC(=O)CC(C)C)c12

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HTR2A P28223 12/20 0.54
▸ HTR1A P08908 4/20 0.51
▸ HTR2C P28335 4/20 0.51
▸ HTR2B P41595 4/20 0.51
▸ HTR6 P50406 2/20 0.51
▸ SLC6A2 P23975 1/20 0.46
▸ HTR1D P28221 2/20 0.44
▸ HTR1B P28222 2/20 0.44
▸ DRD1 P21728 1/20 0.44
▸ HTR1E P28566 1/20 0.44
▸ ADORA2A P29274 1/20 0.44
▸ ADORA2B P29275 1/20 0.44
▸ HTR7 P34969 1/20 0.44
▸ DRD3 P35462 1/20 0.44
▸ HTR5A P47898 1/20 0.44
▸ MTNR1A P48039 1/20 0.44
▸ MTNR1B P49286 1/20 0.44
▸ HTR1F P30939 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
SCHEMBL27085053 0.90 HTR2A (0.59) HTR2AHTR1AHTR2CHTR2BHTR6
SCHEMBL31666425 0.89 HTR2A (0.53) HTR2AHTR1AHTR2CHTR2BHTR6
SCHEMBL27084848 0.89 HTR2A (0.53) HTR2AHTR1AHTR2CHTR2BHTR6
SCHEMBL27085253 0.89 HTR2A (0.61) HTR2AHTR1AHTR2CHTR2BHTR6
SCHEMBL31666424 0.89 HTR2A (0.61) HTR2AHTR1AHTR2CHTR2BHTR6
SCHEMBL27084847 0.87 HTR2A (0.54) HTR2AHTR1AHTR2CHTR2BHTR6
SCHEMBL27085183 0.87 HTR2A (0.56) HTR2AHTR1AHTR2CHTR2BHTR6
SCHEMBL31501492 0.86 HTR6 (0.55) HTR2AHTR1AHTR2CHTR2BHTR6
SCHEMBL29633170 0.86 HTR6 (0.55) HTR2AHTR1AHTR2CHTR2BHTR6
SCHEMBL20970924 0.86 HTR6 (0.55) HTR2AHTR1AHTR2CHTR2BHTR6

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
EP-4592276-A1 NOVEL ACYLOXYMETHYL PRODRUGS OF PSILOCIN AND RELATED 4-HYDROXYTRYPTAMINES OBTAINED BY AN EFFICIENT SYNTHETIC APPROACH Universität Heidelberg (DE) 2025-07-30 — — EP disclosed
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