SCHEMBL19084854

SCHEMBL19084854

Cc1cccc(-n2c3ccncc3c3cc(C)ccc32)c1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ELANE P08246 5/20 0.44
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
ACHE P22303 2/20 0.42
GRIN1 Q05586 1/20 0.42
GRIN2A Q12879 1/20 0.42
MAPT P10636 1/20 0.41
TSHR P16473 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
TDP1 Q9NUW8 1/20 0.39
PSD A5PKW4 1/20 0.39
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
MAPK14 Q16539 1/20 0.36
MAT2A P31153 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL16625774 0.95 ACHE (0.43) ELANEKDM4EALDH1A1ACHEGRIN1
SCHEMBL13098367 0.94 ELANE (0.48) ELANEKDM4EALDH1A1ACHEMAPT
SCHEMBL1611065 0.90 ACHE (0.46) ELANEKDM4EALDH1A1ACHEGRIN1
SCHEMBL19084710 0.88 MAOA (0.47) ELANEKDM4EALDH1A1ACHEMAPT
SCHEMBL4546854 0.86 TDP1 (0.45) KDM4EALDH1A1ACHETDP1MAT2A
SCHEMBL6945928 0.82 TDP1 (0.42) ALDH1A1ACHETDP1MAT2APOLB
SCHEMBL16625773 0.82 ACHE (0.42) ELANEKDM4EALDH1A1ACHEGRIN1
SCHEMBL5030873 0.82 MAOA (0.42) ELANEKDM4EALDH1A1ACHEMAOA
SCHEMBL19380137 0.82 PSD (0.39) ELANEKDM4EALDH1A1MAPTPSD
SCHEMBL12919261 0.81 MAPT (0.36) ELANEKDM4EALDH1A1ACHEGRIN1

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
US-20170194562-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2017-07-06 US disclosed
US-20170194562-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2017-07-06 US disclosed