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Sugi Predict / Compounds / SCHEMBL17999913

SCHEMBL17999913

SCHEMBL17999913

c1ccc(N(c2ccccc2)c2ccc3c4c(cccc24)Oc2cc(N(c4ccccc4)c4cc5ccccc5c5ccccc45)ccc2-3)cc1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ CASP1 P29466 1/20 0.32
▸ HIF1A Q16665 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ L3MBTL1 Q9Y468 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
SCHEMBL17999941 0.97 MAPK1 (0.37) MAPK1KDM4EATMALDH1A1HPGD
SCHEMBL17999954 0.96 KDM4E (0.35) MAPK1KDM4EATM
SCHEMBL17999946 0.93 KDM4E (0.34) MAPK1KDM4EATM
SCHEMBL19588578 0.91 MAPK1 (0.35) MAPK1KDM4EATMALDH1A1HPGD
SCHEMBL17999974 0.90 KDM4E (0.32) MAPK1KDM4EATM
SCHEMBL16282051 0.89 KDM4E (0.37) MAPK1KDM4EATMALDH1A1L3MBTL1
SCHEMBL16805056 0.89 MAPK1 (0.33) MAPK1KDM4EATMALDH1A1HPGD
SCHEMBL17999955 0.89 KDM4E (0.30) MAPK1KDM4EATM
SCHEMBL17999914 0.89 KDM4E (0.38) MAPK1KDM4EATMALDH1A1HIF1A
SCHEMBL17999942 0.89 KDM4E (0.38) MAPK1KDM4EATMALDH1A1HIF1A

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-20160233428-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-08-11 — — US disclosed
US-20160233428-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-08-11 — — US disclosed