SCHEMBL16634497

SCHEMBL16634497

C=CC(=O)Nc1cc(C)c(F)c(B(O)O)c1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 12/20 0.46
F13A1 P00488 2/20 0.39
TGM1 P22735 2/20 0.39
LMNA P02545 1/20 0.39
TGM3 Q08188 1/20 0.39
EGFR P00533 2/20 0.38
BTK Q06187 3/20 0.37
ITK Q08881 1/20 0.36
THRA P10827 1/20 0.35
THRB P10828 1/20 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
SCHEMBL16634474 0.78 TGM2 (0.57) TGM2F13A1TGM1LMNATGM3
SCHEMBL1369735 0.77 TGM2 (0.56) TGM2F13A1TGM1LMNATGM3
SCHEMBL27801542 0.77 TGM2 (0.58) TGM2F13A1TGM1LMNATGM3
SCHEMBL27736873 0.74 TGM2 (0.55) TGM2F13A1TGM1LMNATGM3
SCHEMBL28328517 0.73 TGM2 (0.58) TGM2F13A1TGM1LMNATGM3
SCHEMBL16523986 0.73 TGM2 (0.59) TGM2F13A1TGM1LMNATGM3
SCHEMBL16634556 0.73 TGM2 (0.42) TGM2F13A1TGM1LMNATGM3
SCHEMBL30935247 0.72 TGM2 (0.53) TGM2F13A1TGM1LMNATGM3
SCHEMBL30935106 0.72 TGM2 (0.53) TGM2F13A1TGM1LMNATGM3
SCHEMBL16053417 0.72 TGM2 (0.64) TGM2F13A1TGM1LMNATGM3

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 3 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
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