SCHEMBL7534840

SCHEMBL7534840

CCCN1CCC(c2c[c]ccc2)CC1

nearest known ligand 0.69

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 13/20 0.69
SLC6A4 P31645 2/20 0.55
SIGMAR1 Q99720 1/20 0.53
DRD3 P35462 2/20 0.50
DRD1 P21728 1/20 0.48
DRD4 P21917 1/20 0.48
DRD5 P21918 1/20 0.48
CARM1 Q86X55 1/20 0.48
PRMT6 Q96LA8 1/20 0.48

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
SCHEMBL2183515 0.84 SLC18A3 (0.69) DRD2SIGMAR1CARM1PRMT6
SCHEMBL4576330 0.82 DRD2 (0.70) DRD2SLC6A4SIGMAR1DRD3DRD1
SCHEMBL1443672 0.82 QDPR (0.46) DRD2DRD1DRD5CARM1PRMT6
SCHEMBL3399715 0.82 DRD2 (1.00) DRD2SLC6A4SIGMAR1DRD3DRD1
SCHEMBL27838550 0.78 SLC18A3 (0.41) DRD2SIGMAR1CARM1PRMT6
SCHEMBL3614815 0.76 DRD2 (0.46) DRD2SLC6A4DRD3
SCHEMBL3602055 0.76 DRD2 (0.46) DRD2SLC6A4DRD3
SCHEMBL3610493 0.76 DRD2 (0.46) DRD2SLC6A4DRD3
SCHEMBL21118 0.75
Hydrochloric Acid SCHEMBL3331807 0.75 DRD2 (0.84) DRD2SLC6A4SIGMAR1DRD3DRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1240142-A1 NEW MODULATORS OF DOPAMINE NEUROTRANSMISSION A. Carlsson Research AB (SE) 2002-09-18 EP disclosed
WO-2001046145-A1 NEW MODULATORS OF DOPAMINE NEUROTRANSMISSION A. CARLSSON RESEARCH AB (SE) 2001-06-28 WO disclosed