SCHEMBL9844398

SCHEMBL9844398

CCCN1CCNC(Oc2ccccc2)C1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.44
DRD3 P35462 2/20 0.44
DRD1 P21728 1/20 0.44
DRD4 P21917 1/20 0.44
DRD5 P21918 1/20 0.44
HRH3 Q9Y5N1 1/20 0.40
SIGMAR1 Q99720 1/20 0.40
CARM1 Q86X55 1/20 0.39
PRMT6 Q96LA8 1/20 0.39

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
SCHEMBL15677610 0.75 CARM1 (0.58) DRD2DRD3DRD1DRD4DRD5
SCHEMBL18200131 0.73 CARM1 (0.49) DRD2DRD3DRD1DRD4DRD5
SCHEMBL13896891 0.72 DRD2 (0.60) DRD2DRD3DRD1DRD4DRD5
SCHEMBL20328148 0.71 CARM1 (0.70) DRD2DRD3DRD4HRH3CARM1
SCHEMBL11290526 0.70 GRIN2D (0.33)
SCHEMBL28142218 0.69 LTA4H (0.50) DRD2DRD3DRD4SIGMAR1
SCHEMBL28142214 0.69 LTA4H (0.50) DRD2DRD3DRD4SIGMAR1
SCHEMBL10465528 0.68 LTA4H (0.52) DRD4SIGMAR1
SCHEMBL8349073 0.68 USP2 (0.41) DRD3HRH3SIGMAR1
SCHEMBL6184734 0.68 GRIN1 (0.40) DRD2DRD3

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-0415030-A2 1-Substituted-1,2-dihydro-4-[(substituted)-phenyl]imidazo-[1,5-A]pyrimidine-8-carbonitriles AMERICAN CYANAMID COMPANY (US) 1991-03-06 EP disclosed