SCHEMBL16604167

SCHEMBL16604167

N#Cc1cc2ccc3cc(-c4ccc5ccc6cccc7ccc4c5c67)cc4c3c2c(c1)n4-c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP2 O95551 6/20 0.36
▸ ERBB2 P04626 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ FYN P06241 1/20 0.35
▸ MAOA P21397 1/20 0.35
▸ ACHE P22303 1/20 0.35
▸ AHR P35869 1/20 0.35
▸ PGR P06401 1/20 0.33
▸ CYP1A1 P04798 1/20 0.33
▸ CYP1B1 Q16678 1/20 0.33
▸ XDH P47989 1/20 0.32
▸ SLC22A12 Q96S37 1/20 0.32
▸ PDPK1 O15530 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ BRD1 O95696 1/20 0.30
▸ TAF1 P21675 1/20 0.30
▸ BRPF1 P55201 1/20 0.30
▸ IRAK4 Q9NWZ3 1/20 0.30
▸ G6PD P11413 1/20 0.30

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
SCHEMBL16604130 0.95 PGR (0.36) TDP2ERBB2CYP1A2FYNMAOA
SCHEMBL16604103 0.94 TDP2 (0.36) TDP2PGRXDHSLC22A12KDM4E
SCHEMBL16604101 0.94 PIM1 (0.36) TDP2ERBB2CYP1A2FYNMAOA
SCHEMBL16604138 0.93 XDH (0.35) TDP2PGRXDHSLC22A12PDPK1
SCHEMBL16604135 0.92 TDP2 (0.35) TDP2PGRXDHSLC22A12PDPK1
SCHEMBL16607589 0.91 MCL1 (0.36) TDP2CYP1A2PGRXDHSLC22A12
SCHEMBL16604147 0.90 PGR (0.38) TDP2PGRXDHSLC22A12PDPK1
SCHEMBL16604115 0.90 PGR (0.37) TDP2PGRXDHSLC22A12PDPK1
SCHEMBL16604122 0.90 PGR (0.36) TDP2PGRXDHSLC22A12PDPK1
SCHEMBL16609288 0.89 TDP2 (0.39) TDP2PGRXDHSLC22A12PDPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9680106-B2 Pyrene-based compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-13 — — US disclosed
US-9680106-B2 Pyrene-based compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-13 — — US disclosed
US-20150090967-A1 PYRENE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-04-02 — — US disclosed
US-20150090967-A1 PYRENE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-04-02 — — US disclosed
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