SCHEMBL18899208

SCHEMBL18899208

CC(c1ccc(-c2ccc(N(c3ccccc3)c3cccc4ccccc34)cc2)cc1)C(Cc1ccccc1)c1cccc2ccccc12

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ACP3 P15309 4/20 0.42
SIGMAR1 Q99720 6/20 0.37
L3MBTL1 Q9Y468 1/20 0.34
ADRB3 P13945 1/20 0.33
SLC6A4 P31645 1/20 0.33
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32

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
SCHEMBL19784819 0.85 ACP3 (0.43) ACP3SIGMAR1L3MBTL1ADRB3SLC6A4
SCHEMBL21168602 0.82 SIGMAR1 (0.38) ACP3SIGMAR1SLC6A4ALDH1A1CYP1A2
SCHEMBL24831546 0.81 SIGMAR1 (0.39) ACP3SIGMAR1L3MBTL1SLC6A4CYP1A2
SCHEMBL25681219 0.81 ACP3 (0.46) ACP3SIGMAR1L3MBTL1ADRB3SLC6A4
SCHEMBL21699699 0.81 ACP3 (0.46) ACP3SIGMAR1L3MBTL1ADRB3SLC6A4
SCHEMBL20273883 0.81 ACP3 (0.49) ACP3SIGMAR1L3MBTL1SLC6A4ALDH1A1
SCHEMBL18389579 0.81 ACP3 (0.46) ACP3SIGMAR1L3MBTL1ADRB3SLC6A4
SCHEMBL19020359 0.80 SIGMAR1 (0.38) ACP3SIGMAR1L3MBTL1SLC6A4CYP1A2
SCHEMBL18899325 0.80 ACP3 (0.37) ACP3SIGMAR1ADRB3
SCHEMBL19784820 0.80 ACP3 (0.41) ACP3SIGMAR1L3MBTL1ADRB3SLC6A4

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-2478576-B1 ORGANIC ELECTRONIC DEVICE AND DOPANT FOR DOPING AN ORGANIC SEMICONDUCTING MATRIX MATERIAL OSRAM OLED GMBH (DE) 2017-05-31 EP disclosed