SCHEMBL19745145

SCHEMBL19745145

O=C(O)COc1cc(C(=O)O)c(O)c(C(=O)O)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.50
PTPN7 P35236 2/20 0.46
HSD17B10 Q99714 2/20 0.45
HPGD P15428 1/20 0.45
PTPRB P23467 1/20 0.45
LMNA P02545 1/20 0.44
THRA P10827 1/20 0.44
THRB P10828 1/20 0.44
ALDH1A1 P00352 2/20 0.43
PPARD Q03181 1/20 0.43
TSHR P16473 1/20 0.42
MCL1 Q07820 1/20 0.42
FFAR1 O14842 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CD69 Q07108 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
PTPN12 Q05209 1/20 0.41

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
SCHEMBL28645298 0.80 ALOX15 (0.65) ALOX15PTPN7HSD17B10HPGDPTPRB
SCHEMBL19745546 0.78 ALDH1A1 (0.45) ALDH1A1SMN1; SMN2
SCHEMBL8528993 0.78 PTPN7 (0.58) ALOX15PTPN7HSD17B10LMNAALDH1A1
SCHEMBL3138757 0.76 ALOX15 (0.50) ALOX15PTPN7HSD17B10HPGDPTPRB
SCHEMBL6516217 0.76 HPGD (0.62) ALOX15PTPN7HSD17B10HPGDPTPRB
SCHEMBL9522071 0.76 THRA (0.56) ALOX15PTPN7HSD17B10HPGDPTPRB
SCHEMBL3301562 0.76 PPARD (0.66) ALOX15PTPN7HSD17B10HPGDLMNA
SCHEMBL8528987 0.76 PTGDR2 (0.55) ALOX15PTPN7HSD17B10LMNAALDH1A1
SCHEMBL19745151 0.76 GAA (0.50) HPGDLMNAALDH1A1TSHRFFAR1
SCHEMBL11095614 0.75 HMGB1 (0.51) HSD17B10HPGDPTPRBLMNATHRA

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
WO-2017222921-A1 2-HYDROXYISOPHTHALIC ACID AND ITS DERIVATIVES: METHODS OF MAKING AND APPLICATIONS XAVIER UNIVERSITY OF LOUISIANA (US) 2017-12-28 WO disclosed