SCHEMBL1235458

SCHEMBL1235458

Nc1c(C(=O)c2c(F)c(F)c(F)c(F)c2F)ccc2c1C(=O)OC21c2ccc(O)cc2Oc2cc(O)ccc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FTO Q9C0B1 10/20 0.52
MAPT P10636 3/20 0.49
HPGD P15428 2/20 0.49
MEN1 O00255 2/20 0.49
HTT P42858 2/20 0.49
KMT2A Q03164 2/20 0.49
CYP2C19 P33261 1/20 0.49
RECQL P46063 1/20 0.49
BLM P54132 1/20 0.49
SMAD3 P84022 1/20 0.49
PRMT1 Q99873 1/20 0.49
ACE2 Q9BYF1 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
ALDH1A1 P00352 2/20 0.47
ALOX12 P18054 2/20 0.47
CYP2C9 P11712 1/20 0.47
ALOX15 P16050 1/20 0.47
BRCA1 P38398 1/20 0.47
HSD17B10 Q99714 1/20 0.47
JAK2 O60674 2/20 0.35

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
SCHEMBL7521638 0.88 FTO (0.53) FTOMAPTHPGDMEN1HTT
SCHEMBL6479542 0.84 FTO (0.58) FTOMAPTHPGDMEN1HTT
SCHEMBL9405138 0.82 FTO (0.54) FTOMAPTHPGDMEN1HTT
SCHEMBL5496952 0.81 FTO (0.55) FTOMAPTHPGDMEN1HTT
SCHEMBL139173 0.80 FTO (0.65) FTOMAPTHPGDMEN1HTT
SCHEMBL601176 0.78 FTO (0.59) FTOMAPTHPGDMEN1HTT
SCHEMBL6037012 0.77 ALDH1A1 (0.56) FTOMAPTHPGDMEN1HTT
SCHEMBL6511956 0.77 FTO (0.50) FTOMAPTHPGDMEN1HTT
SCHEMBL4576798 0.77 FTO (0.58) FTOMAPTHPGDMEN1HTT
SCHEMBL7907421 0.76 ALDH1A1 (0.53) FTOMAPTHPGDMEN1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8221773-B2 Hydrogels and uses thereof UNIVERSITY OF DELAWARE (US) 2012-07-17 US disclosed
US-20110165200-A1 NOVEL HYDROGELS AND USES THEREOF UNIVERSITY OF DELAWARE (US) 2011-07-07 US disclosed
US-20110052692-A1 NOVEL HYDROGELS AND USES THEREOF UNIVERSITY OF DELAWARE (US) 2011-03-03 US disclosed
US-7884185-B2 A polypeptide hydrogel that may be formed by the self-assembly of peptides in solution and brought about by a change of the hydrogel e.g. pH, ionic strength, temperature, concentration of specific ions; drug delivery; wound healing; tissue engineering UNIVERSITY OF DELAWARE (US) 2011-02-08 US disclosed
US-7858585-B2 Hydrogels and uses thereof UNIVERSITY OF DELAWARE (US) 2010-12-28 US disclosed
EP-1962870-A2 NOVEL HYDROGELS AND USES THEREOF University of Delaware Technology Corporation (US) 2008-09-03 EP disclosed
US-20070128175-A1 Novel hydorgels and uses thereof NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2007-06-07 US disclosed
WO-2007059491-A2 NOVEL HYDROGELS AND USES THEREOF UNIVERSITY OF DELAWARE TECHNOLOGY CORPORATION (US) 2007-05-24 WO disclosed
EP-1781336-A2 NOVEL HYDROGELS AND USES THEREOF UNIVERSITY OF DELAWARE (US) 2007-05-09 EP disclosed
WO-2006076042-A9 NOVEL HYDROGELS AND USES THEREOF UNIV DELAWARE (US) 2007-02-08 WO disclosed
WO-2006076042-A2 NOVEL HYDROGELS AND USES THEREOF UNIVERSITY OF DELAWARE (US) 2006-07-20 WO disclosed
US-20060025524-A1 Novel hydrogels and uses thereof UNIVERSITY OF DELAWARE (US) 2006-02-02 US disclosed