SCHEMBL16634491

SCHEMBL16634491

C=CC(=O)Nc1ccc(F)cc1B(O)O

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 3/20 0.51
ALDH1A1 P00352 1/20 0.44
CYP2C19 P33261 1/20 0.44
MAPK3 P27361 4/20 0.42
LIPE Q05469 1/20 0.41
EGFR P00533 1/20 0.40
HTT P42858 1/20 0.40
BRD4 O60885 2/20 0.39
TEK Q02763 2/20 0.39
KDR P35968 1/20 0.39
LMNA P02545 1/20 0.38
FGFR4 P22455 2/20 0.38

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
SCHEMBL29505769 0.80 ALDH1A1 (0.66) TGM2ALDH1A1CYP2C19EGFRHTT
SCHEMBL8549226 0.80 ALDH1A1 (0.66) TGM2ALDH1A1CYP2C19EGFRHTT
SCHEMBL17524751 0.79 TGM2 (0.53) TGM2ALDH1A1CYP2C19MAPK3EGFR
SCHEMBL1370187 0.78 MAPT (0.47) ALDH1A1CYP2C19LIPEHTT
SCHEMBL236887 0.77 TGM2 (0.52) TGM2MAPK3EGFRLMNA
SCHEMBL29954870 0.77 TGM2 (0.52) TGM2MAPK3EGFRLMNA
SCHEMBL18764924 0.77 TGM2 (0.58) TGM2ALDH1A1CYP2C19EGFRHTT
SCHEMBL29505767 0.77 TGM2 (0.58) TGM2ALDH1A1CYP2C19EGFRHTT
SCHEMBL29757976 0.77 TGM2 (0.56) TGM2ALDH1A1HTTLMNA
SCHEMBL23652894 0.76 TGM2 (0.53) TGM2ALDH1A1CYP2C19MAPK3EGFR

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-10088476-B2 Volume response sensors having analyte controlled reversible crosslinking THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2018-10-02 US disclosed
US-20160252505-A1 VOLUME RESPONSE SENSORS HAVING ANALYTE CONTROLLED REVERSIBLE CROSSLINKING THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOI S (US) 2016-09-01 US disclosed
EP-2522679-B1 PHENYLBORONIC ACID MONOMER AND PHENYLBORONIC ACID POLYMER NAT INST FOR MATERIALS SCIENCE (JP) 2016-07-13 EP disclosed
WO-2015053975-A1 VOLUME RESPONSE SENSORS HAVING CONTROLLED REVERSIBLE CROSSLINKING THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2015-04-16 WO disclosed