SCHEMBL8823733

SCHEMBL8823733

CNC(=O)c1cccc2c1CC(N)CO2

nearest known ligand 0.70

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.40

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
SCHEMBL8823728 1.00 DRD2 (0.40) DRD2
SCHEMBL5764199 0.83 ALDH1A1 (0.46) DRD2
SCHEMBL5761600 0.82 PARP1 (0.43) DRD2
SCHEMBL8823727 0.77 DRD2 (0.43) DRD2
SCHEMBL8447239 0.76 DRD2 (0.58) DRD2
SCHEMBL4750426 0.76 ALDH1A1 (0.47)
SCHEMBL5760572 0.76 HTR1A (0.47)
SCHEMBL4746893 0.76 ALDH1A1 (0.47)
SCHEMBL841567 0.76 SCN9A (0.48)
SCHEMBL4750442 0.76 CNR1 (0.47)

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5641807-A Method for the treatment of depression ASTRA AKTIEBOLAG (SE) 1997-06-24 US disclosed
US-5639772-A Chroman derivatives ASTRA AKTIEBOLAG (SE) 1997-06-17 US disclosed
US-5500425-A Chroman derivatives and a method of treating 5-HT mediated disorders AKTIEBOLAGET ASTRA (SE) 1996-03-19 US disclosed