SCHEMBL16632947

SCHEMBL16632947

Brc1ccc2ccc3c(-c4cccc(-c5ccccc5)c4)ccc4ccc1c2c43

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.41
MAOA P21397 2/20 0.36
ERBB2 P04626 1/20 0.36
FYN P06241 1/20 0.36
ACHE P22303 1/20 0.36
AHR P35869 1/20 0.36
CYP1B1 Q16678 4/20 0.35
THRB P10828 2/20 0.35
MEN1 O00255 1/20 0.35
APAF1 O14727 1/20 0.35
NPC1 O15118 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
XBP1 P17861 1/20 0.35
PTBP1 P26599 1/20 0.35
HTT P42858 1/20 0.35
RAB9A P51151 1/20 0.35
GALK1 P51570 1/20 0.35
BLM P54132 1/20 0.35
SMAD3 P84022 1/20 0.35

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
SCHEMBL22256169 0.92 CRHBP (0.39) CYP1A2MAOAERBB2FYNACHE
SCHEMBL22256166 0.89 HSD17B1 (0.42) CYP1A2MAOAERBB2FYNACHE
SCHEMBL2292638 0.88 ALDH1A1 (0.43) CYP1A2MAOAERBB2FYNACHE
SCHEMBL2293036 0.88 ALDH1A1 (0.43) CYP1A2MAOAERBB2FYNACHE
Biphenyl SCHEMBL27806904 0.84 ALDH1A1 (0.42) CYP1A2MAOAERBB2FYNACHE
SCHEMBL38664102 0.84 CYP1A2 (0.39) CYP1A2MAOAERBB2FYNACHE
SCHEMBL22256236 0.84 CYP1A2 (0.45) CYP1A2MAOAERBB2FYNACHE
SCHEMBL13682550 0.83 MAOB (0.42) CYP1A2MAOAERBB2FYNACHE
SCHEMBL27723548 0.83 CYP1A2 (0.39) CYP1A2MAOAERBB2FYNACHE
SCHEMBL31488899 0.83 ESR1 (0.43) CYP1A2MAOAERBB2FYNACHE

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017104767-A1 COMPOUND FOR ORGANIC ELECTROLUMINESCENT ELEMENT AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME TDK株式会社 2017-06-22 WO disclosed
US-9293712-B2 Disubstituted pyrene compounds with amino group containing ortho aryl group and devices containing the same UNIVERSAL DISPLAY CORPORATION (US) 2016-03-22 US disclosed
US-9293712-B2 Disubstituted pyrene compounds with amino group containing ortho aryl group and devices containing the same UNIVERSAL DISPLAY CORPORATION (US) 2016-03-22 US disclosed
US-9293712-B2 Disubstituted pyrene compounds with amino group containing ortho aryl group and devices containing the same UNIVERSAL DISPLAY CORPORATION (US) 2016-03-22 US disclosed
US-20150102321-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2015-04-16 US disclosed
US-20150102321-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2015-04-16 US disclosed
US-20150102321-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2015-04-16 US disclosed