SCHEMBL25969854

SCHEMBL25969854

COc1ccc(N2CCc3ccccc3[C@@H]2OC)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 4/20 0.51
GID4 Q8IVV7 1/20 0.47
DRD2 P14416 4/20 0.46
DRD4 P21917 3/20 0.46
HTR1A P08908 1/20 0.46
HTR1D P28221 1/20 0.46
HTR2A P28223 1/20 0.46
ALDH1A1 P00352 2/20 0.44
MAPT P10636 2/20 0.44
RAB9A P51151 2/20 0.44
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 1/20 0.44
HPGD P15428 1/20 0.44
KMT2A Q03164 1/20 0.44
HDAC1 Q13547 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
DRD5 P21918 3/20 0.42
DRD3 P35462 3/20 0.42
SIGMAR1 Q99720 1/20 0.42
NPC1 O15118 1/20 0.41

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
SCHEMBL2600446 0.88 PRCP (0.45) DRD1ALDH1A1MAPTKDM4EGAA
SCHEMBL28921436 0.85 DRD1 (0.46) DRD1GID4DRD2DRD4HTR1A
SCHEMBL28921440 0.83 DRD1 (0.44) DRD1GID4DRD2DRD4HTR1A
SCHEMBL28598656 0.82 DRD1 (0.48) DRD1GID4DRD2DRD4HTR1A
SCHEMBL29170205 0.79 DRD1 (0.45) DRD1GID4DRD2DRD4HTR1A
SCHEMBL30296945 0.79 DRD1 (0.45) DRD1GID4DRD2DRD4HTR1A
SCHEMBL16684242 0.77 DRD1 (0.43) DRD1GID4DRD2DRD4HTR1A
SCHEMBL12685743 0.77 DRD1 (0.43) DRD1GID4DRD2DRD4HTR1A
SCHEMBL30296909 0.77 DRD1 (0.41) DRD1GID4DRD2DRD4HTR1A
SCHEMBL29170196 0.77 DRD1 (0.41) DRD1GID4DRD2DRD4HTR1A

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-4212477-A1 NOVEL CARBON NITRIDE COMPOSITIONS AND THEIR USE AS PHOTOELECTRODES Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2023-07-19 EP disclosed