SCHEMBL8201701

SCHEMBL8201701

O=C(O)OC1CCC(O)CC1

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.37
SERPINE1 P05121 1/20 0.33
TSHR P16473 1/20 0.32
EPHX1 P07099 1/20 0.31

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
SCHEMBL26834 0.89 SERPINE1 (0.38) SERPINE1EPHX1
SCHEMBL1138479 0.89 SERPINE1 (0.38) SERPINE1EPHX1
SCHEMBL374062 0.89
SCHEMBL126557 0.89 SERPINE1 (0.38) SERPINE1EPHX1
Hydrochloric Acid SCHEMBL4395687 0.86
Cyclohexane SCHEMBL7797729 0.83 EPHX1 (0.43) SERPINE1EPHX1
SCHEMBL7859197 0.81 EPHX2 (0.44) EPHX2SERPINE1TSHREPHX1
SCHEMBL17707747 0.78 EPHX1 (0.43) SERPINE1EPHX1
SCHEMBL906168 0.78 SERPINE1 (0.35) SERPINE1
SCHEMBL1463400 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3380551-A1 POLYMERIC FLAME RETARDANT MIXTURES Clariant Plastics & Coatings Ltd (CH) 2018-10-03 EP disclosed
WO-2017089293-A1 POLYMERIC FLAME RETARDANT MIXTURES CLARIANT INTERNATIONAL LTD (CH) 2017-06-01 WO disclosed
US-8658725-B2 Material having cross-linked polyrotaxane, and method for producing same ADVANCED SOFTMATERIALS INC. (JP) 2014-02-25 US disclosed
US-20120316278-A1 MATERIAL HAVING CROSS-LINKED POLYROTAXANE, AND METHOD FOR PRODUCING SAME ADVANCED SOFTMATERIALS INC. (JP) 2012-12-13 US disclosed
WO-2000002459-A1 FOIL FOR AIR-DRIED OR SMOKED FOOD PRODUCTS Götz, Walter 2000-01-20 WO disclosed