SCHEMBL7769953

SCHEMBL7769953

Cc1cccc(N2CCN(CCCCNC(=O)c3ccc4c(c3)C(=O)c3ccccc3-4)CC2)c1C

nearest known ligand 0.75

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 11/20 0.75
DRD3 P35462 10/20 0.75
ADRA1A P35348 2/20 0.74
DRD4 P21917 4/20 0.67
HTR2A P28223 9/20 0.60
HTR2C P28335 9/20 0.60
HTR1A P08908 3/20 0.60
SLC6A4 P31645 6/20 0.59
MEN1 O00255 1/20 0.59
KMT2A Q03164 1/20 0.59

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
Hydrochloric Acid SCHEMBL7766264 0.99 DRD2 (0.73) DRD2DRD3ADRA1ADRD4HTR2A
Hydrochloric Acid SCHEMBL7535217 0.92 DRD2 (0.73) DRD2DRD3ADRA1ADRD4HTR2A
Hydrochloric Acid SCHEMBL7421291 0.89 DRD3 (0.81) DRD2DRD3ADRA1ADRD4HTR2A
Hydrochloric Acid SCHEMBL7421290 0.89 DRD3 (0.81) DRD2DRD3ADRA1ADRD4HTR2A
SCHEMBL7769974 0.87 DRD2 (0.76) DRD2DRD3ADRA1ADRD4HTR2A
SCHEMBL7766329 0.87 DRD3 (0.89) DRD2DRD3ADRA1ADRD4HTR2A
Hydrochloric Acid SCHEMBL7766165 0.86 DRD2 (0.75) DRD2DRD3ADRA1ADRD4HTR2A
SCHEMBL7765356 0.86 DRD2 (0.76) DRD2DRD3ADRA1ADRD4HTR2A
Hydrochloric Acid SCHEMBL7762622 0.86 DRD3 (0.88) DRD2DRD3ADRA1ADRD4HTR2A
Hydrochloric Acid SCHEMBL7765433 0.85 DRD2 (0.75) DRD2DRD3ADRA1ADRD4HTR2A

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-0873329-B1 NOVEL N-AMINOALKYLFLUORENECARBOXAMIDES; A NEW CLASS OF DOPAMINE RECEPTOR SUBTYPE SPECIFIC LIGANDS NEUROGEN CORP (US) 2001-06-06 EP claimed