SCHEMBL10190807

SCHEMBL10190807

C1=Cc2c(c3cc(Nc4ccccc4)ccc3n2-c2ccccc2)CC1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ AR P10275 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ HSP90AA1 P07900 1/20 0.33
▸ HSD17B10 Q99714 3/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ ALOX12 P18054 1/20 0.33
▸ PTGS1 P23219 1/20 0.33
▸ SLC6A2 P23975 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ PTGS2 P35354 1/20 0.33
▸ HTR2B P41595 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.32

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
SCHEMBL18872780 0.87 HSP90AA1 (0.37) ALDH1A1MAPTHSP90AA1HSD17B10CYP3A4
SCHEMBL11888670 0.85 KDM4E (0.38) L3MBTL1KDM4EATM
SCHEMBL12557529 0.84 HSP90AA1 (0.35) ALDH1A1HSP90AA1HSD17B10L3MBTL1ALOX15
SCHEMBL24296375 0.81 ALDH1A1 (0.36) ALDH1A1MEN1MAPTKMT2AHPGD
SCHEMBL21539289 0.81 ALDH1A1 (0.39) ALDH1A1MEN1MAPTKMT2AHSD17B10
SCHEMBL13445292 0.81 HTR6 (0.37) ALDH1A1MEN1MAPTKMT2AHSD17B10
SCHEMBL17522890 0.81 KDM4E (0.34) L3MBTL1KDM4EATM
SCHEMBL21695062 0.80 EPHX2 (0.34) ALDH1A1HSP90AA1L3MBTL1KDM4EATM
SCHEMBL19977472 0.80 DNMT1 (0.33) L3MBTL1TSHRMAPK1KDM4EATM
SCHEMBL12939244 0.80 L3MBTL1 (0.48) ALDH1A1MEN1MAPTKMT2ACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8106392-B2 Anthracene derivative, and light-emitting element, light-emitting device, electronic device using anthracene derivative SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2012-01-31 — — US disclosed
US-20110062428-A1 Anthracene Derivative, and Light-Emitting Element, Light-Emitting Device, Electronic Device Using Anthracene Derivative SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2011-03-17 — — US disclosed
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