SCHEMBL28075649

SCHEMBL28075649

Cc1c([N+](=O)[O-])cc(C(=O)O)c(C(=O)ON)c1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.45
L3MBTL1 Q9Y468 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
POLB P06746 2/20 0.38
DTYMK P23919 1/20 0.38
ALDH1A1 P00352 3/20 0.37
LMNA P02545 2/20 0.37
GALR2 O43603 1/20 0.37
MITF O75030 1/20 0.37
HSP90AA1 P07900 1/20 0.37
HPGD P15428 1/20 0.37
XBP1 P17861 1/20 0.37
CCR6 P51684 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
PDGFRB P09619 1/20 0.37
FGFR1 P11362 1/20 0.37
PDGFRA P16234 1/20 0.37
FLT1 P17948 1/20 0.37
FGFR3 P22607 1/20 0.37

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
SCHEMBL4907793 0.84 TSHR (0.53) TSHRL3MBTL1TDP1POLBDTYMK
SCHEMBL4907783 0.84 TSHR (0.53) TSHRL3MBTL1TDP1POLBDTYMK
SCHEMBL6727081 0.77 TSHR (0.56) TSHRL3MBTL1TDP1POLBDTYMK
SCHEMBL441532 0.77 TSHR (0.47) TSHRL3MBTL1TDP1POLBALDH1A1
SCHEMBL28075705 0.76 KDM4E (0.49) TSHRTDP1POLBALDH1A1HPGD
SCHEMBL4581662 0.74 TSHR (0.53) TSHRL3MBTL1TDP1POLBDTYMK
SCHEMBL2299143 0.74 TSHR (0.53) TSHRL3MBTL1TDP1POLBDTYMK
SCHEMBL14336810 0.74 TSHR (0.45) TSHRL3MBTL1TDP1POLBALDH1A1
SCHEMBL11760497 0.74 TDP1 (0.51) TSHRL3MBTL1TDP1LMNACCR6
SCHEMBL14337146 0.73 ALDH1A1 (0.41) TSHRTDP1POLBALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105622548-A High-temperature-resistant glycidyl amine type multifunctional epoxy resin and preparation method thereof UNIV HEFEI TECHNOLOGY 2016-06-01 CN disclosed