SCHEMBL9440934

SCHEMBL9440934

CCC[PH](CCC)(CCC)OS(=O)(=O)c1cc(C(=O)OC)cc(C(=O)OC)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.40
LMNA P02545 2/20 0.39
POLB P06746 2/20 0.39
CA12 O43570 2/20 0.39
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA9 Q16790 2/20 0.39
CA14 Q9ULX7 2/20 0.39
CA7 P43166 1/20 0.39
ALDH1A1 P00352 7/20 0.38
HSD17B10 Q99714 1/20 0.38
HPGD P15428 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
GAA P10253 1/20 0.38
NFKB1 P19838 1/20 0.38
XDH P47989 1/20 0.38
GFER P55789 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
FUT7 Q11130 1/20 0.38

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
SCHEMBL9440620 0.92 KDM4E (0.38) KDM4ELMNAPOLBCA12CA1
SCHEMBL9440692 0.89 MGLL (0.38) KDM4ELMNAALDH1A1HSD17B10L3MBTL1
SCHEMBL9440399 0.88 KDM4E (0.42) KDM4ELMNAPOLBCA12CA1
SCHEMBL9440910 0.85 LCK (0.44) CA12CA1CA2CA9CA14
SCHEMBL9440646 0.79 LOX (0.45) KDM4EPOLBCA12CA1CA2
SCHEMBL9440386 0.78 HPGD (0.46) KDM4ELMNAPOLBCA1CA2
SCHEMBL9440731 0.77 LCK (0.42) CA12CA2CA9CYP1A2TSHR
SCHEMBL9440360 0.76 L3MBTL1 (0.43) KDM4ELMNAPOLBALDH1A1HPGD
SCHEMBL9440792 0.76 L3MBTL1 (0.43) KDM4ELMNAPOLBALDH1A1HPGD
SCHEMBL10088208 0.76 CA12 (0.50) KDM4ELMNAPOLBCA12CA1

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-0280026-B1 Copolyester fiber TEIJIN LTD (JP) 1994-03-30 EP disclosed
US-4851504-A Cationically-dyeable, thermally-resistant copolyester fiber comprising quaternary phosphonium organic sulfonate groups TEIJIN LIMITED (JP) 1989-07-25 US disclosed
EP-0280026-A2 Copolyester fiber TEIJIN LIMITED (JP) 1988-08-31 EP disclosed