SCHEMBL3655004

SCHEMBL3655004

[O]c1ccccc1OCC(F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.44
ALDH1A1 P00352 3/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
KDM4E B2RXH2 2/20 0.44
USP2 O75604 1/20 0.44
HSP90AA1 P07900 1/20 0.44
HSP90AB1 P08238 1/20 0.44
THRB P10828 1/20 0.44
G6PD P11413 1/20 0.44
ALOX15 P16050 1/20 0.44
CASP1 P29466 1/20 0.44
HSD17B10 Q99714 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
HTT P42858 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
S1PR2 O95136 1/20 0.41
S1PR4 O95977 1/20 0.41
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.41

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
SCHEMBL28288419 0.84 MAPT (0.52) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL3032749 0.81 MAPT (0.45) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL10316560 0.79 L3MBTL1 (0.53) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL4400621 0.79 ALDH1A1 (0.36) MAPTALDH1A1L3MBTL1HTTNPSR1
SCHEMBL943074 0.78 MAPT (0.42) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL29635641 0.77 L3MBTL1 (0.48) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL10499330 0.77 L3MBTL1 (0.48) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL28060228 0.77 RXRA (0.50) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL5413155 0.76 L3MBTL1 (0.55) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL6003548 0.76 DRD1 (0.46) MAPTALDH1A1KDM4EL3MBTL1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4242499-A Colored polymers comprising poly(organophosphazenes) with chromophores as substituent groups THE FIRESTONE TIRE & RUBBER COMPANY (US) 1980-12-30 US claimed
EP-2207773-A2 HETEROCYCLIC COMPOUND AND PHARMACEUTICAL COMPOSITION THEREOF Otsuka Pharmaceutical Co., Ltd. (JP) 2010-07-21 EP disclosed
EP-2089373-A1 STAT3/5 ACTIVATION INHIBITOR OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2009-08-19 EP disclosed
WO-2009057811-A2 HETEROCYCLIC COMPOUND AND PHARMACEUTICAL COMPOSITION THEREOF OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2009-05-07 WO disclosed
EP-1957073-A2 MEDICINAL DRUG OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2008-08-20 EP disclosed
WO-2008044667-A1 STAT3/5 ACTIVATION INHIBITOR OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2008-04-17 WO disclosed
WO-2007066784-A2 DIARYLETHER DERIVATIVES AS ANTITUMOR AGENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-06-14 WO disclosed
EP-1773797-A2 AROMATIC COMPOUNDS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-04-18 EP disclosed
WO-2006014012-A2 AROMATIC COMPOUNDS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-02-09 WO disclosed