SCHEMBL6237240

SCHEMBL6237240

COC(=O)c1cccc([O])c1OC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.50
LMNA P02545 1/20 0.50
ALDH1A1 P00352 3/20 0.48
HSD17B10 Q99714 3/20 0.48
CFTR P13569 1/20 0.48
KDM4E B2RXH2 5/20 0.47
POLB P06746 4/20 0.47
ATM Q13315 2/20 0.47
GAA P10253 3/20 0.47
HPGD P15428 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
KMT2A Q03164 3/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CA9 Q16790 2/20 0.44
CA12 O43570 1/20 0.44
CA7 P43166 1/20 0.44
CA14 Q9ULX7 1/20 0.44
MAPT P10636 2/20 0.43
CA5A P35218 1/20 0.43

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
SCHEMBL3511611 0.88 TSHR (0.57) TSHRLMNAALDH1A1HSD17B10CFTR
SCHEMBL6240686 0.82 CA1 (0.44) TSHRLMNAALDH1A1HSD17B10CFTR
SCHEMBL699415 0.82 LMNA (0.52) TSHRLMNAALDH1A1HSD17B10CFTR
SCHEMBL23092927 0.81 LMNA (0.50) TSHRLMNAALDH1A1HSD17B10CFTR
SCHEMBL4496440 0.81 APEX1 (0.51) TSHRLMNAALDH1A1HSD17B10CFTR
Methyl 3-Hydroxy-2-Methoxybenzoate SCHEMBL1050662 0.81 LMNA (0.66) TSHRLMNAALDH1A1HSD17B10CFTR
Methyl 2,3-Dimethoxybenzoate SCHEMBL311487 0.81 GAA (0.66) TSHRLMNAALDH1A1HSD17B10KDM4E
SCHEMBL3530454 0.80 KDM4E (0.49) TSHRLMNAALDH1A1HSD17B10CFTR
SCHEMBL162835 0.79 TSHR (0.63) TSHRLMNAALDH1A1HSD17B10CFTR
SCHEMBL16953740 0.79 TSHR (0.48) TSHRLMNAALDH1A1HSD17B10CFTR

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
EP-1063252-B1 FLAME-RETARDANT RESIN, COMPOSITION THEREOF, AND PROCESS FOR PRODUCING THE SAME OTSUKA KAGAKU KK (JP) 2005-06-08 EP disclosed
US-6632891-B1 Obtained by an ester exchange reaction between the flame retardant phosphazene and the polycarbonate or polyester resin OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 2003-10-14 US disclosed
EP-1063252-A1 FLAME-RETARDANT RESIN, COMPOSITION THEREOF, AND PROCESS FOR PRODUCING THE SAME OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 2000-12-27 EP disclosed