SCHEMBL1720515

SCHEMBL1720515

COc1cc(-c2ccc(N(C(=O)O)c3ccccc3)c(OC)c2)ccc1N(C(=O)O)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.43
APAF1 O14727 1/20 0.43
RECQL P46063 1/20 0.43
CASP6 P55212 1/20 0.43
CACNA1B Q00975 1/20 0.43
APBA1 Q02410 1/20 0.43
MCL1 Q07820 1/20 0.43
CASP8 Q14790 1/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
TSHR P16473 1/20 0.43
TRPM8 Q7Z2W7 2/20 0.41
PDE4A P27815 4/20 0.40
PDE4B Q07343 4/20 0.40
PDE4C Q08493 4/20 0.40
PDE4D Q08499 4/20 0.40
HPGD P15428 3/20 0.40
NPSR1 Q6W5P4 1/20 0.40
MAPT P10636 1/20 0.40
PTGIR P43119 1/20 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
SCHEMBL713040 0.83 PTGIR (0.51) MEN1KMT2ATSHRTRPM8NPSR1
SCHEMBL9140139 0.78 ALDH1A1 (0.42) KDM4EAPAF1RECQLCASP6CACNA1B
SCHEMBL7244019 0.75 TSHR (0.44) KDM4EMEN1KMT2ATSHRTRPM8
SCHEMBL4601280 0.74 PAX8 (0.50) KMT2ATSHRNPSR1MAPTPTGIR
SCHEMBL16776764 0.74 MAPK14 (0.43) KDM4ERECQLMEN1KMT2ATSHR
SCHEMBL9952361 0.73 KDM4E (0.55) KDM4EAPAF1RECQLCASP6CACNA1B
SCHEMBL7623811 0.73 AR (0.44) MEN1KMT2ATSHRPTGIR
SCHEMBL14163844 0.72 ALDH1A1 (0.41) KDM4EMEN1KMT2ATSHRHPGD
SCHEMBL31393778 0.72 PAX8 (0.56) APAF1MEN1KMT2ATSHRTRPM8
SCHEMBL14570732 0.72 TSHR (0.39) KDM4EAPAF1RECQLCASP6CACNA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170306386-A1 YEAST SCREENS FOR TREATMENT OF HUMAN DISEASE THE UNIVERSITY OF CHICAGO (US) 2017-10-26 US disclosed
US-20130005608-A1 YEAST SCREENS FOR TREATMENT OF HUMAN DISEASE THE UNIVERSITY OF CHICAGO (US) 2013-01-03 US disclosed
EP-1392849-B2 YEAST SCREENS FOR AGENTS AFFECTING PROTEIN FOLDING UNIV CHICAGO (US) 2012-01-18 EP disclosed
EP-2319936-A2 Yeast screens for agents affecting protein folding The University of Chicago (US) 2011-05-11 EP disclosed
EP-1392849-B1 YEAST SCREENS FOR AGENTS AFFECTING PROTEIN FOLDING UNIV CHICAGO (US) 2008-01-02 EP disclosed
EP-1793001-A2 Yeast screens for agents affecting protein folding The University of Chicago (US) 2007-06-06 EP disclosed
EP-1392849-A2 YEAST SCREENS FOR AGENTS AFFECTING PROTEIN FOLDING THE UNIVERSITY OF CHICAGO (US) 2004-03-03 EP disclosed
WO-2002065136-A2 YEAST SCREENS FOR AGENTS AFFECTING PROTEIN FOLDING UNIVERSITY OF CHICAGO (US) 2002-08-22 WO disclosed