SCHEMBL18697309

SCHEMBL18697309

Cc1cc(OC(=O)F)ccc1OC(=O)F

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.42
KDM4E B2RXH2 3/20 0.40
KMT2A Q03164 2/20 0.40
ALDH1A1 P00352 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TDP1 Q9NUW8 2/20 0.39
NPC1 O15118 1/20 0.39
ACHE P22303 2/20 0.39
MAPT P10636 1/20 0.36
PPARD Q03181 2/20 0.36
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
LMNA P02545 2/20 0.35
GLA P06280 1/20 0.35
GAA P10253 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL8458217 0.78 ACHE (0.47) L3MBTL1KDM4EKMT2AALDH1A1SMN1; SMN2
SCHEMBL29535063 0.78 KDM4E (0.58) KDM4EKMT2AALDH1A1TDP1NPC1
SCHEMBL2541390 0.78 KDM4E (0.58) KDM4EKMT2AALDH1A1TDP1NPC1
SCHEMBL23833723 0.77 L3MBTL1 (0.36) L3MBTL1KDM4EKMT2AALDH1A1SMN1; SMN2
SCHEMBL2540263 0.75 ELANE (0.56) L3MBTL1KDM4EKMT2AALDH1A1SMN1; SMN2
SCHEMBL18697310 0.74 NCEH1 (0.38) L3MBTL1KDM4EKMT2AALDH1A1ACHE
SCHEMBL11332752 0.74 ACHE (0.59) L3MBTL1KDM4EKMT2AALDH1A1SMN1; SMN2
SCHEMBL1696567 0.74 THRB (0.47) L3MBTL1KDM4EKMT2AALDH1A1SMN1; SMN2
SCHEMBL7044116 0.74 ELANE (0.50) L3MBTL1KDM4EKMT2AALDH1A1SMN1; SMN2
SCHEMBL18697272 0.74 BCHE (0.51) L3MBTL1KMT2ASMN1; SMN2TDP1NPC1

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
US-20170194664-A1 NONAQUEOUS ELECTROLYTE AND ELECTRICITY STORING DEVICE IN WHICH SAME IS USED MU IONIC SOLUTIONS CORPORATION (JP) 2017-07-06 US disclosed
US-20170194664-A1 NONAQUEOUS ELECTROLYTE AND ELECTRICITY STORING DEVICE IN WHICH SAME IS USED MU IONIC SOLUTIONS CORPORATION (JP) 2017-07-06 US disclosed
EP-3151326-A1 NONAQUEOUS ELECTROLYTE AND ELECTRICITY-STORING DEVICE IN WHICH SAME IS USED Ube Industries, Ltd. (JP) 2017-04-05 EP disclosed