SCHEMBL778451

SCHEMBL778451

O=P(O)(C=Cc1ccccc1F)C1CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 7/20 0.43
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
MAPT P10636 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
C3AR1 Q16581 1/20 0.38
MAOB P27338 1/20 0.36
SRC P12931 1/20 0.35
KMT2A Q03164 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP1B1 Q16678 1/20 0.35
MITF O75030 1/20 0.34
LMNA P02545 1/20 0.34
HSP90AA1 P07900 1/20 0.34

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
SCHEMBL31590622 0.78 TRPM8 (0.42) RAB9AMAPTSMN1; SMN2CYP1A2CYP2D6
SCHEMBL31590153 0.76 TRPM8 (0.40) NPC1RAB9AMAPTSMN1; SMN2CYP1A2
SCHEMBL31590446 0.73 TRPM8 (0.40) NPC1RAB9AMAPTSMN1; SMN2KMT2A
SCHEMBL779745 0.73 NFE2L2 (0.54) NFE2L2NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL779472 0.70 NFE2L2 (0.50) NFE2L2MAPTMAOBCYP1A2CYP2D6
SCHEMBL781471 0.69 NFE2L2 (0.48) NFE2L2NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL778166 0.67 NFE2L2 (0.46) NFE2L2NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL777584 0.66 KMT2A (0.37) NPC1RAB9AMAPTSMN1; SMN2KMT2A
SCHEMBL778614 0.66 KMT2A (0.37) NPC1RAB9AMAPTSMN1; SMN2KMT2A
SCHEMBL777536 0.66 DHODH (0.36) NPC1RAB9ASMN1; SMN2KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9608291-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2017-03-28 US disclosed
US-9343777-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2016-05-17 US disclosed
US-9252457-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2016-02-02 US disclosed
US-20150188192-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2015-07-02 US disclosed
US-20120070731-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2012-03-22 US disclosed
US-20090325065-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2009-12-31 US disclosed