SCHEMBL4659659

SCHEMBL4659659

Brc1ccc2c3ccc4ccccc4c3c3c4ccc5ccccc5c4c(Br)c4ccc1c2c43

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPRT1 P00492 3/20 0.40
▸ POLB P06746 1/20 0.40
▸ HSD17B10 Q99714 4/20 0.39
▸ TSHR P16473 2/20 0.39
▸ HPGD P15428 2/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ HIF1A Q16665 2/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ CASP1 P29466 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ CASP7 P55210 1/20 0.39
▸ ATM Q13315 1/20 0.39
▸ ALDH1A1 P00352 4/20 0.38
▸ TDP1 Q9NUW8 2/20 0.38
▸ CYP2A6 P11509 1/20 0.38
▸ CYP1A2 P05177 3/20 0.38
▸ THRB P10828 1/20 0.38
▸ ERBB2 P04626 1/20 0.35
▸ FYN P06241 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
SCHEMBL5173827 0.88 POLB (0.39) HPRT1POLBHSD17B10TSHRHPGD
SCHEMBL2848750 0.81 HPRT1 (0.50) HPRT1POLBHSD17B10TSHRHPGD
SCHEMBL27047549 0.81 HPRT1 (0.50) HPRT1POLBHSD17B10TSHRHPGD
SCHEMBL11299922 0.80 HPRT1 (0.60) HPRT1HSD17B10TSHRHPGDL3MBTL1
SCHEMBL14110174 0.78 ALDH1A1 (0.50) HPRT1POLBHSD17B10TSHRHPGD
SCHEMBL12200678 0.77 HSD17B10 (0.67) HPRT1POLBHSD17B10TSHRHPGD
SCHEMBL31006766 0.77 HSD17B10 (0.67) HPRT1POLBHSD17B10TSHRHPGD
SCHEMBL16781267 0.77 HPRT1 (0.58) HPRT1POLBHSD17B10TSHRHPGD
SCHEMBL1377289 0.77 HPRT1 (0.50) HPRT1POLBHSD17B10TSHRHPGD
SCHEMBL11197647 0.77 HPRT1 (0.50) HPRT1POLBHSD17B10TSHRHPGD

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
EP-1310473-B1 Dinaphthopyrene compound, and organic EL element and organic EL display using the same FUJIFILM CORP (JP) 2008-12-10 — — EP disclosed
US-6783872-B2 SUCH AS 5,8-BIS(DIPHENYLAMINO)DINAPHTHO(2':3?-3:4)(2?:3?-9:10) PYRENE FOR EMISSION OF GREEN LIGHT; ELECTROLUMINESCENCE (EL) FUJITSU LIMITED (JP) 2004-08-31 — — US disclosed
US-20030113579-A1 Dinaphthopyrene compound, and organic EL element and organic EL display using the same FUJITSU LIMITED (JP) 2003-06-19 — — US disclosed
EP-1310473-A1 Dinaphthopyrene compounds, organic EL element and organic EL display using the same FUJITSU LIMITED (JP) 2003-05-14 — — EP disclosed
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