SCHEMBL16781267

SCHEMBL16781267

Brc1ccc(Br)c2c1ccc1c3ccccc3ccc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPRT1 P00492 4/20 0.58
▸ HSD17B10 Q99714 4/20 0.50
▸ ALDH1A1 P00352 4/20 0.50
▸ TSHR P16473 2/20 0.50
▸ TDP1 Q9NUW8 2/20 0.50
▸ CYP2A6 P11509 1/20 0.50
▸ CYP1A2 P05177 4/20 0.48
▸ HPGD P15428 3/20 0.48
▸ THRB P10828 1/20 0.48
▸ ERBB2 P04626 1/20 0.44
▸ FYN P06241 1/20 0.44
▸ MAOA P21397 1/20 0.44
▸ ACHE P22303 1/20 0.44
▸ AHR P35869 1/20 0.44
▸ PAX8 Q06710 1/20 0.43
▸ HIF1A Q16665 3/20 0.43
▸ CYP1B1 Q16678 1/20 0.43
▸ POLB P06746 1/20 0.41
▸ MAPK1 P28482 3/20 0.40
▸ CYP3A4 P08684 2/20 0.40

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
SCHEMBL27047549 0.91 HPRT1 (0.50) HPRT1HSD17B10ALDH1A1TSHRTDP1
SCHEMBL17342504 0.83 CYP1A2 (0.48) HPRT1HSD17B10ALDH1A1TSHRTDP1
SCHEMBL27105533 0.83 HSD17B10 (0.60) HPRT1HSD17B10ALDH1A1TSHRTDP1
SCHEMBL31006766 0.83 HSD17B10 (0.67) HPRT1HSD17B10ALDH1A1TSHRTDP1
SCHEMBL31108073 0.83 HSD17B10 (0.60) HPRT1HSD17B10ALDH1A1TSHRTDP1
SCHEMBL12200678 0.83 HSD17B10 (0.67) HPRT1HSD17B10ALDH1A1TSHRTDP1
SCHEMBL2679230 0.82 HPRT1 (0.56) HPRT1HSD17B10ALDH1A1TSHRTDP1
SCHEMBL1527416 0.80 HPRT1 (0.67) HPRT1HSD17B10ALDH1A1TSHRTDP1
SCHEMBL27107379 0.80 HPRT1 (0.67) HPRT1HSD17B10ALDH1A1TSHRTDP1
SCHEMBL17332284 0.80 CYP1A2 (0.71) HPRT1HSD17B10ALDH1A1TSHRTDP1

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-10062850-B2 Amine-based compounds and organic light-emitting devices comprising the same SAMSUNG DISPLAY CO., LTD. (KR) 2018-08-28 — — US disclosed
US-9966535-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2018-05-08 — — US disclosed
US-20160133845-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-05-12 — — US disclosed
US-20150171337-A1 AMINE-BASED COMPOUNDS AND ORGANIC LIGHT-EMITTING DEVICES COMPRISING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-06-18 — — US disclosed
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