SCHEMBL16604130

SCHEMBL16604130

N#Cc1cc2ccc3cc(-c4ccc(-c5ccc6ccc7cccc8ccc5c6c78)cc4)cc4c3c2c(c1)n4-c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 2/20 0.36
▸ TDP2 O95551 5/20 0.34
▸ ERBB2 P04626 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ FYN P06241 1/20 0.33
▸ MAOA P21397 1/20 0.33
▸ ACHE P22303 1/20 0.33
▸ AHR P35869 1/20 0.33
▸ XDH P47989 1/20 0.32
▸ SLC22A12 Q96S37 1/20 0.32
▸ PDPK1 O15530 1/20 0.31
▸ IRAK4 Q9NWZ3 1/20 0.31
▸ CYP1A1 P04798 1/20 0.31
▸ CYP1B1 Q16678 1/20 0.31
▸ HSD17B1 P14061 1/20 0.30
▸ HSD17B2 P37059 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
SCHEMBL16604115 0.96 PGR (0.37) PGRTDP2XDHSLC22A12PDPK1
SCHEMBL16604120 0.95 PGR (0.35) PGRTDP2XDHSLC22A12PDPK1
SCHEMBL16604167 0.95 TDP2 (0.36) PGRTDP2ERBB2CYP1A2FYN
SCHEMBL16604148 0.94 PIM1 (0.36) PGRTDP2ERBB2CYP1A2FYN
SCHEMBL16604147 0.92 PGR (0.38) PGRTDP2XDHSLC22A12PDPK1
SCHEMBL16604103 0.91 TDP2 (0.36) PGRTDP2XDHSLC22A12IRAK4
SCHEMBL16607575 0.91 PGR (0.41) PGRTDP2XDHSLC22A12PDPK1
SCHEMBL16604122 0.91 PGR (0.36) PGRTDP2XDHSLC22A12PDPK1
SCHEMBL16604138 0.90 XDH (0.35) PGRTDP2XDHSLC22A12PDPK1
SCHEMBL16788686 0.90 CYP1A2 (0.40) ERBB2CYP1A2FYNMAOAACHE

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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