SCHEMBL914795

SCHEMBL914795

O=P(O)(O)Cc1ccc(S(=O)(=O)c2ccc(OCCO)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
MMP2 P08253 5/20 0.43
MMP9 P14780 4/20 0.43
MMP13 P45452 3/20 0.43
MMP12 P39900 2/20 0.43
GAA P10253 3/20 0.41
LMNA P02545 1/20 0.41
PKM P14618 1/20 0.41
PTPN1 P18031 2/20 0.41
RECQL P46063 1/20 0.40
MMP8 P22894 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MMP1 P03956 1/20 0.38
MMP3 P08254 1/20 0.38
MMP14 P50281 1/20 0.38
PGK1 P00558 3/20 0.38
PGK2 P07205 3/20 0.38
CYP3A4 P08684 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NR1I2 O75469 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
SCHEMBL915259 0.89 ALDH1A1 (0.48) ALDH1A1GAALMNAPTPN1RECQL
SCHEMBL4439210 0.88 ALDH1A1 (0.46) ALDH1A1MMP2MMP9MMP12GAA
SCHEMBL915316 0.87 MMP2 (0.45) ALDH1A1MMP2MMP9MMP13MMP12
SCHEMBL916009 0.86 ALDH1A1 (0.46) ALDH1A1MMP2MMP9MMP13GAA
SCHEMBL915529 0.85 GAA (0.44) ALDH1A1MMP2MMP9MMP13MMP12
SCHEMBL916704 0.84 ALDH1A1 (0.44) ALDH1A1GAAPTPN1RECQLPGK1
SCHEMBL915318 0.84 PTPN1 (0.53) ALDH1A1GAAPTPN1RECQLPGK1
SCHEMBL2637714 0.84 ALDH1A1 (0.58) ALDH1A1MMP2MMP9MMP13MMP12
SCHEMBL34118 0.84 ALDH1A1 (0.58) ALDH1A1MMP2MMP9MMP13MMP12
Ethylene Glycol SCHEMBL8592846 0.82 ALDH1A1 (0.56) ALDH1A1MMP2MMP9MMP13MMP12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7868126-B2 Process for producing polyester, polyester produced using said process, and polyester molded product TOYO BOSEKI KABUSHIKI KAISHA (JP) 2011-01-11 US disclosed
EP-1842868-B1 PROCESS FOR PRODUCING POLYESTER, POLYESTER PRODUCED USING SAID PROCESS, AND POLYESTER MOLDED PRODUCT TOYO BOSEKI (JP) 2010-11-10 EP disclosed
US-20080249280-A1 Process for Producing Polyester, Polyester Produced Using Said Process, and Polyester Molded Product TOYO BOSEKI KABUSHIKI KAISHA (JP) 2008-10-09 US disclosed
EP-1842868-A1 PROCESS FOR PRODUCING POLYESTER, POLYESTER PRODUCED USING SAID PROCESS, AND POLYESTER MOLDED PRODUCT Toyo Boseki Kabushiki Kasisha (JP) 2007-10-10 EP disclosed