SCHEMBL17835327

SCHEMBL17835327

C=C(C)C(=O)OCCOc1ccc(-c2nc(-c3ccc(OCC)cc3OCC)nc(-c3ccc(OCC)cc3OCC)n2)c(O)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 3/20 0.42
▸ POLB P06746 3/20 0.42
▸ APEX1 P27695 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ KMT2A Q03164 9/20 0.41
▸ MEN1 O00255 8/20 0.41
▸ MAPT P10636 7/20 0.41
▸ TP53 P04637 5/20 0.41
▸ NPSR1 Q6W5P4 5/20 0.41
▸ SMN1; SMN2 Q16637 4/20 0.41
▸ USP2 O75604 4/20 0.41
▸ MAPK1 P28482 4/20 0.41
▸ HSP90AA1 P07900 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ KDM4E B2RXH2 3/20 0.41
▸ LMNA P02545 6/20 0.41
▸ ADORA3 P0DMS8 1/20 0.39
▸ ALDH1A1 P00352 5/20 0.39
▸ ALOX12 P18054 5/20 0.39
▸ HPGD P15428 3/20 0.39

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
SCHEMBL16191954 0.92 MEN1 (0.44) HTTPOLBAPEX1TDP1KMT2A
SCHEMBL29512602 0.92 MEN1 (0.44) HTTPOLBAPEX1TDP1KMT2A
SCHEMBL17835328 0.87 ADORA3 (0.46) HTTPOLBAPEX1TDP1KMT2A
SCHEMBL28737904 0.87 MEN1 (0.42) HTTPOLBAPEX1TDP1KMT2A
SCHEMBL16191439 0.85 THRB (0.44) HTTPOLBKMT2AMEN1MAPT
SCHEMBL16191348 0.84 MAPT (0.48) HTTPOLBAPEX1TDP1KMT2A
SCHEMBL29512503 0.84 MAPT (0.48) HTTPOLBAPEX1TDP1KMT2A
SCHEMBL8975412 0.83 HTT (0.61) HTTPOLBAPEX1TDP1KMT2A
SCHEMBL30887158 0.83 HTT (0.61) HTTPOLBAPEX1TDP1KMT2A
SCHEMBL16191553 0.83 HTT (0.42) HTTPOLBAPEX1TDP1KMT2A

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-20160200884-A1 FILM COMPRISING VINYLIDENE FLUORIDE RESIN, LAMINATED FILM, AND LAMINATE MITSUBISHI RAYON CO., LTD. (JP) 2016-07-14 — — US disclosed
EP-3034556-A1 FILM COMPRISING VINYLIDENE FLUORIDE RESIN, LAMINATED FILM, AND LAMINATE Mitsubishi Rayon Co., Ltd. (JP) 2016-06-22 — — EP disclosed
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