SCHEMBL31545930

SCHEMBL31545930

CC(C)(CCCCO[N+](=O)[O-])c1cc(O)c2c(c1)OC(C)(C)[C@H]1CCC(CO)=C[C@H]21

nearest known ligand 0.72

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ DRD3 P35462 2/20 0.72
▸ CNR2 P34972 11/20 0.57
▸ CNR1 P21554 8/20 0.57
▸ NR1I2 O75469 1/20 0.49
▸ ADORA3 P0DMS8 1/20 0.49
▸ SLC6A3 Q01959 1/20 0.49
▸ GLRA1 P23415 1/20 0.49

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
SCHEMBL17388428 1.00 DRD3 (0.72) DRD3CNR2CNR1NR1I2ADORA3
SCHEMBL31546114 0.99 DRD3 (0.74) DRD3CNR2CNR1NR1I2ADORA3
SCHEMBL31545238 0.99 DRD3 (0.74) DRD3CNR2CNR1NR1I2ADORA3
SCHEMBL17388532 0.99 DRD3 (0.74) DRD3CNR2CNR1NR1I2ADORA3
SCHEMBL17388329 0.99 DRD3 (0.74) DRD3CNR2CNR1NR1I2ADORA3
SCHEMBL31545000 0.97 DRD3 (0.71) DRD3CNR2CNR1NR1I2ADORA3
SCHEMBL17388682 0.97 DRD3 (0.71) DRD3CNR2CNR1NR1I2ADORA3
SCHEMBL17388506 0.94 DRD3 (0.68) DRD3CNR2CNR1NR1I2ADORA3
SCHEMBL31545575 0.94 DRD3 (0.68) DRD3CNR2CNR1NR1I2ADORA3
SCHEMBL17388530 0.90 CNR2 (0.71) DRD3CNR2CNR1NR1I2ADORA3

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
US-20250090554-A1 A METHOD OF TREATING DEPRESSION BY IMMUNE MODULATION MYND LIFE SCIENCES INC (CA) 2025-03-20 — — US disclosed
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