SCHEMBL23174129

SCHEMBL23174129

CC1(C)c2cccc(-c3ccccc3)c2Oc2c1cccc2P(=O)(c1ccccc1)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 1/20 0.40
NPSR1 Q6W5P4 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
HTR1A P08908 2/20 0.33
HTR7 P34969 2/20 0.33
HTR2B P41595 2/20 0.33
TMEM97 Q5BJF2 2/20 0.33
SIGMAR1 Q99720 2/20 0.33
TOP1 P11387 1/20 0.32
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
HTT P42858 1/20 0.31

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
SCHEMBL5078882 0.90 DRD1 (0.46) DRD1NPSR1MEN1KMT2AALDH1A1
SCHEMBL29570778 0.90 DRD1 (0.46) DRD1NPSR1MEN1KMT2AALDH1A1
SCHEMBL29699088 0.90 DRD1 (0.46) DRD1NPSR1MEN1KMT2AALDH1A1
SCHEMBL23181343 0.84 DRD1 (0.41) DRD1NPSR1MEN1KMT2AALDH1A1
SCHEMBL21603047 0.83 DRD1 (0.53) DRD1HTR1AHTR7HTR2BTMEM97
SCHEMBL18304637 0.83 DRD1 (0.40) DRD1NPSR1MEN1KMT2AALDH1A1
SCHEMBL29412647 0.83 DRD1 (0.40) DRD1NPSR1MEN1KMT2AALDH1A1
SCHEMBL10016845 0.81 DRD1 (0.39) DRD1NPSR1MEN1KMT2AALDH1A1
SCHEMBL16638799 0.81 DRD1 (0.39) DRD1NPSR1MEN1KMT2AALDH1A1
SCHEMBL10154120 0.79 DRD1 (0.71) DRD1NPSR1MEN1KMT2A

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
WO-2021058759-A1 ORGANIC SEMICONDUCTOR LAYER, ORGANIC ELECTRONIC DEVICE COMPRISING THE SAME AND COMPOUNDS THEREFOR NOVALED GMBH (DE) 2021-04-01 WO disclosed
EP-3798213-A1 ORGANIC SEMICONDUCTOR LAYER, ORGANIC ELECTRONIC DEVICE COMPRISING THE SAME AND COMPOUNDS THEREFOR Novaled GmbH (DE) 2021-03-31 EP disclosed