SCHEMBL8900407

SCHEMBL8900407

C=CCN1C(=O)CC2c3ccccc3CCC21

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ HTR1A P08908 10/20 0.59
▸ SIGMAR1 Q99720 2/20 0.49
▸ SRD5A1 P18405 2/20 0.49
▸ DRD2 P14416 3/20 0.43
▸ PRCP P42785 3/20 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
SCHEMBL8901616 1.00 HTR1A (0.59) HTR1ASIGMAR1SRD5A1DRD2PRCP
SCHEMBL8901539 0.80 HTR1A (0.64) HTR1ADRD2
SCHEMBL8901535 0.80 HTR1A (0.64) HTR1ADRD2
SCHEMBL8901537 0.80 HTR1A (0.64) HTR1ADRD2
SCHEMBL8901899 0.80 HTR1A (0.64) HTR1ADRD2
SCHEMBL8902000 0.78 HTR1A (0.67) HTR1ADRD2
SCHEMBL8901985 0.74 HTR1A (1.00) HTR1ADRD2
SCHEMBL8901989 0.74 HTR1A (1.00) HTR1ADRD2
Hydrochloric Acid SCHEMBL8899975 0.73 HTR1A (0.97) HTR1ADRD2
Hydrochloric Acid SCHEMBL8901650 0.73 HTR1A (0.97) HTR1ADRD2

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-0482084-B1 (1,2N) AND (3,2N)-CARBOCYCLIC-2-AMINO TETRALIN DERIVATIVES UPJOHN CO (US) 1997-05-07 — — EP disclosed
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