SCHEMBL2152125

SCHEMBL2152125

COCCOC(C)C(=O)OC

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.38
CA14 Q9ULX7 2/20 0.35
TSHR P16473 3/20 0.35
CA12 O43570 2/20 0.33
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CA9 Q16790 1/20 0.32
ALDH1A1 P00352 2/20 0.31
TAS1R3 Q7RTX0 1/20 0.31
TAS1R1 Q7RTX1 1/20 0.31
HPGD P15428 1/20 0.31
HTT P42858 1/20 0.31
RAB9A P51151 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
SCHEMBL30179216 0.94 KMT2A (0.37) SMN1; SMN2CA14TSHRCA12CA2
SCHEMBL18357023 0.86 TSHR (0.39) SMN1; SMN2TSHRCA12CA1CA2
SCHEMBL28019693 0.83 ALDH1A1 (0.39) TSHRMGAMGAASIMGAM2
SCHEMBL3030911 0.82 CA1 (0.41) SMN1; SMN2CA14TSHRCA12CA1
SCHEMBL4373898 0.82 SMN1; SMN2 (0.38) SMN1; SMN2CA14TSHRCA12CA1
SCHEMBL9634932 0.82 CA1 (0.41) SMN1; SMN2CA14TSHRCA12CA1
SCHEMBL24021664 0.81 TSHR (0.32) TSHR
SCHEMBL21877017 0.79 CA12 (0.33) CA14TSHRCA12CA1CA2
SCHEMBL7561602 0.79 MEN1 (0.42) SMN1; SMN2CA14TSHRALDH1A1HTT
SCHEMBL7080897 0.79 TSHR (0.32) TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1240125-B2 FLUORINE CONTAINING VINYL ETHERS 3M INNOVATIVE PROPERTIES CO (US) 2016-04-20 EP disclosed
EP-1616849-B1 Process for the preparation of fluorine containing vinyl ethers 3M INNOVATIVE PROPERTIES CO (US) 2011-07-06 EP disclosed
EP-1616849-A2 Process for the preparation of fluorine containing vinyl ethers DYNEON LLC (US) 2006-01-18 EP disclosed
EP-1240125-B1 FLUORINE CONTAINING VINYL ETHERS DYNEON LLC (US) 2005-11-02 EP disclosed
EP-1240125-A1 FLUORINE CONTAINING VINYL ETHERS DYNEON LLC (US) 2002-09-18 EP disclosed
US-6255536-B1 FLOURINATING A 2-ALKOXY PROPIONATE MOIETY THAT MAY BE PARTIALLY HALOGENATED TO PROVIDE A PERFLUORINATED INTERMEDIATE, CONVERTING TO ITS ACID METAL SALT, AND THEN TO ITS PERFLUOROVINYL ETHER DYNEON LLC 2001-07-03 US disclosed
WO-2001046107-A1 FLUORINE CONTAINING VINYL ETHERS DYNEON LLC (US) 2001-06-28 WO disclosed