SCHEMBL7120240

SCHEMBL7120240

O=C(O)c1cccc(C(=O)OCCCC(O)O)c1S(=O)(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.40
TDP1 Q9NUW8 5/20 0.40
L3MBTL1 Q9Y468 3/20 0.40
CYP3A4 P08684 3/20 0.39
MAPK1 P28482 3/20 0.39
TP53 P04637 2/20 0.39
ALDH1A1 P00352 8/20 0.38
LMNA P02545 1/20 0.38
ALOX15 P16050 1/20 0.37
HSD17B10 Q99714 3/20 0.36
PRKCG P05129 2/20 0.35
PRKCB P05771 2/20 0.35
PRKCA P17252 2/20 0.35
PRKCE Q02156 2/20 0.35
PRKCD Q05655 2/20 0.35
PRKCH P24723 1/20 0.35
KDM4E B2RXH2 1/20 0.35
POLB P06746 1/20 0.35
SCN1A P35498 1/20 0.34
SCN2A Q99250 1/20 0.34

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
SCHEMBL7124318 0.95 ALDH1A1 (0.43) TSHRTDP1L3MBTL1CYP3A4MAPK1
SCHEMBL27318264 0.84 TSHR (0.44) TSHRTDP1L3MBTL1CYP3A4MAPK1
SCHEMBL7115648 0.83 ALDH1A1 (0.41) TSHRL3MBTL1CYP3A4TP53ALDH1A1
SCHEMBL2116927 0.82 ALOX15 (0.41) TSHRTDP1L3MBTL1CYP3A4MAPK1
SCHEMBL27492001 0.78 ALDH1A1 (0.69) TSHRTDP1L3MBTL1CYP3A4MAPK1
SCHEMBL7120234 0.78 ALDH1A1 (0.37) TSHRCYP3A4ALDH1A1ALOX15
SCHEMBL7124315 0.78 PRSS1 (0.36) TSHRCYP3A4ALDH1A1LMNAALOX15
SCHEMBL433519 0.77 TSHR (0.56) TSHRTDP1L3MBTL1CYP3A4TP53
SCHEMBL11516243 0.76 TSHR (0.54) TSHRTDP1L3MBTL1CYP3A4TP53
SCHEMBL14720272 0.76 TSHR (0.54) TSHRTDP1CYP3A4ALDH1A1LMNA

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-0669358-B1 BIODEGRADABLE COPOLYESTER, MOLDING PRODUCED THEREFROM, AND PROCESS FOR PRODUCING THE MOLDING KANEBO LTD (JP) 2003-11-19 EP disclosed
US-5593778-A FIBERS, FABRICS, LACTIC ACID, POLYETHYLENE GLYCOL, A DICARBOXYPHENYL SULFONATE MONOMER KANEBO, LTD. (JP) 1997-01-14 US disclosed
EP-0669358-A1 BIODEGRADABLE COPOLYESTER, MOLDING PRODUCED THEREFROM, AND PROCESS FOR PRODUCING THE MOLDING KANEBO LTD. (JP) 1995-08-30 EP disclosed