SCHEMBL3923488

SCHEMBL3923488

C=CC(=O)Oc1c(CCC)c(C(=O)O)c(C(=O)O)c(OC(=O)C=C)c1OC(=O)C=C

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
THRB P10828 4/20 0.45
THRA P10827 1/20 0.36
TSHR P16473 3/20 0.34
HPGD P15428 1/20 0.34
LDHA P00338 2/20 0.33
LDHB P07195 2/20 0.33
PTPN1 P18031 3/20 0.30
PTPN11 Q06124 2/20 0.30
PTPN2 P17706 1/20 0.30
ALDH1A1 P00352 2/20 0.30
TP53 P04637 2/20 0.30
HIF1A Q16665 2/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL27941274 0.81 THRB (0.39) THRBTHRATSHRHPGD
SCHEMBL27343945 0.75 THRB (0.43) THRBTHRATSHRHPGD
SCHEMBL27467706 0.75 THRB (0.47) THRBTHRATSHRHPGDALDH1A1
SCHEMBL27898006 0.74 LMNA (0.35) THRB
SCHEMBL27343944 0.73 THRB (0.36) THRBTHRATSHRHPGD
SCHEMBL27894856 0.73 THRB (0.36) THRBTHRATSHRHPGD
SCHEMBL17393738 0.73 THRB (0.36) THRBTHRATSHRHPGD
SCHEMBL27588784 0.72 THRB (0.44) THRBTHRATSHRHPGD
SCHEMBL17393734 0.71 THRB (0.48) THRBTHRAPTPN1PTPN11PTPN2
SCHEMBL17393726 0.71 THRB (0.48) THRBTHRATSHRHPGDLDHA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1922585-B1 PHOTOSENSITIVE COMPOSITION COMPRISING TRIAZINE-BASED PHOTOACTIVE COMPOUND CONTAINING OXIME ESTER LG CHEMICAL LTD (KR) 2016-06-15 EP disclosed
US-7556910-B2 Photosensitive composition comprising triazine-based photoactive compound containing oxime ester LF Chem, Ltd. (KR) 2009-07-07 US disclosed
EP-1922585-A1 PHOTOSENSITIVE COMPOSITION COMPRISING TRIAZINE-BASED PHOTOACTIVE COMPOUND CONTAINING OXIME ESTER LG Chem, Ltd. (KR) 2008-05-21 EP disclosed
WO-2007064102-A1 PHOTOSENSITIVE COMPOSITION COMPRISING TRIAZINE-BASED PHOTOACTIVE COMPOUND CONTAINING OXIME ESTER LG CHEM. LTD. (KR) 2007-06-07 WO disclosed
US-20070128548-A1 Photosensitive composition comprising triazine-based photoactive compound containing oxime ester LG CHEM, LTD. (KR) 2007-06-07 US disclosed