SCHEMBL8845593

SCHEMBL8845593

CCCN(CCC(C1CC1)C1CC1)[C@H]1CCc2cc3ccoc3cc2C1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 11/20 0.50
HTR1A P08908 5/20 0.50
FYN P06241 1/20 0.49
DRD2 P14416 8/20 0.47
DRD4 P21917 4/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
ADRB2 P07550 1/20 0.46
CYP2D6 P10635 1/20 0.46
CASP1 P29466 1/20 0.46
LMNA P02545 2/20 0.46
MAPT P10636 1/20 0.46

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
SCHEMBL7439800 0.90 DRD3 (0.59) DRD3HTR1AFYNDRD2DRD4
SCHEMBL8845373 0.84 DRD3 (0.53) DRD3HTR1AFYNDRD2DRD4
SCHEMBL8845112 0.82 DRD3 (0.51) DRD3HTR1AFYNDRD2DRD4
SCHEMBL6950529 0.82 DRD3 (0.51) DRD3HTR1AFYNDRD2DRD4
SCHEMBL7435721 0.82 FYN (0.54) DRD3HTR1AFYNDRD2DRD4
SCHEMBL8845314 0.81 DRD3 (0.50) DRD3HTR1AFYNDRD2DRD4
SCHEMBL8845120 0.80 FYN (0.38) DRD3HTR1AFYNDRD2DRD4
SCHEMBL8845292 0.80 DRD3 (0.48) DRD3HTR1AFYNDRD2DRD4
SCHEMBL8845611 0.80 DRD3 (0.64) DRD3HTR1AFYNDRD2DRD4
SCHEMBL8845164 0.80 DRD3 (0.52) DRD3HTR1AFYNDRD2DRD4

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-5665765-A TREATMENT OF PARKINSON'S DISEASE, MEMORY DISORDERS, DISORDERS ASSOCIATED WITH DRUG ABUSE, DEPRESSION, AND PSYCHOTIC STATES ADIR ET COMPAGNIE (FR) 1997-09-09 US disclosed