SCHEMBL17017299

SCHEMBL17017299

CC(=O)Nc1cc(N)ccc1N1CCN(c2ccc(N)cc2NC(C)=O)CC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.52
▸ KMT2A Q03164 7/20 0.50
▸ POLB P06746 2/20 0.50
▸ WDR5 P61964 4/20 0.49
▸ MAPT P10636 5/20 0.46
▸ MEN1 O00255 4/20 0.46
▸ KDM4E B2RXH2 2/20 0.46
▸ THRB P10828 2/20 0.46
▸ ALOX15 P16050 1/20 0.46
▸ GFER P55789 1/20 0.46
▸ YWHAG P61981 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ GAA P10253 2/20 0.46
▸ MAPK1 P28482 2/20 0.46
▸ HTT P42858 1/20 0.45
▸ RAD52 P43351 1/20 0.44
▸ NR4A1 P22736 1/20 0.42
▸ PTK2B Q14289 1/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ TSHR P16473 1/20 0.42

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
SCHEMBL10126893 0.94 WDR5 (0.56) ALDH1A1KMT2APOLBWDR5MAPT
SCHEMBL15651563 0.93 CASP6 (0.54) ALDH1A1KMT2APOLBWDR5MAPT
SCHEMBL3265395 0.90 ALDH1A1 (0.67) ALDH1A1KMT2APOLBMAPTMEN1
SCHEMBL10126927 0.82 WDR5 (0.49) ALDH1A1KMT2APOLBWDR5MAPT
SCHEMBL24900576 0.80 ALDH1A1 (0.40) ALDH1A1KMT2APOLBWDR5MAPT
SCHEMBL24900469 0.80 WDR5 (0.52) ALDH1A1WDR5GAA
SCHEMBL24900551 0.80 WDR5 (0.52) ALDH1A1WDR5GAA
SCHEMBL24900458 0.80 WDR5 (0.52) ALDH1A1WDR5GAA
SCHEMBL30879250 0.79 TSHR (0.56) ALDH1A1KMT2AWDR5MAPTMEN1
SCHEMBL16095355 0.78 EGFR (0.51) ALDH1A1KMT2AWDR5MAPTKDM4E

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-20150329781-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT CHI MEI CORPORATION (TW) 2015-11-19 — — US disclosed
US-20150329781-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT CHI MEI CORPORATION (TW) 2015-11-19 — — US disclosed
US-20150232665-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM AND LIQUID CRYSTAL DISPLAY ELEMENT HAVING THEREOF CHI MEI CORPORATION (TW) 2015-08-20 — — US disclosed
US-20150232665-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM AND LIQUID CRYSTAL DISPLAY ELEMENT HAVING THEREOF CHI MEI CORPORATION (TW) 2015-08-20 — — US disclosed
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