SCHEMBL25409614

SCHEMBL25409614

O=C(OC(=O)c1c(F)c(F)c(F)c(F)c1F)c1ccccc1.O=C(OC(=O)c1ccc(F)cc1)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 4/20 0.51
▸ RAB9A P51151 4/20 0.51
▸ PKM P14618 1/20 0.51
▸ PLA2G7 Q13093 1/20 0.46
▸ KMT2A Q03164 6/20 0.46
▸ POLB P06746 3/20 0.46
▸ LMNA P02545 3/20 0.44
▸ F2 P00734 1/20 0.44
▸ MAPT P10636 3/20 0.43
▸ MEN1 O00255 3/20 0.41
▸ KCNK3 O14649 1/20 0.41
▸ KCNK9 Q9NPC2 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ CES2 O00748 1/20 0.41
▸ CES1 P23141 1/20 0.41
▸ BCL2L1 Q07817 1/20 0.40
▸ BAD Q92934 1/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ ALPG P10696 1/20 0.40

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
SCHEMBL25409613 0.93 CES2 (0.46) NPC1RAB9APKMKMT2AMAPT
SCHEMBL776290 0.93 LMNA (0.50) NPC1RAB9APKMPLA2G7KMT2A
SCHEMBL775621 0.89 NPC1 (0.61) NPC1RAB9APKMPLA2G7KMT2A
Acetic Acid SCHEMBL777114 0.84 RAB9A (0.56) NPC1RAB9APKMPLA2G7KMT2A
SCHEMBL14160623 0.81 TSHR (0.44) NPC1RAB9APKMKMT2APOLB
SCHEMBL775620 0.81 CES2 (0.59) NPC1RAB9APKMKMT2AMAPT
SCHEMBL18050292 0.80 NPC1 (0.56) NPC1RAB9APKMPLA2G7KMT2A
SCHEMBL18050294 0.80 NPC1 (0.56) NPC1RAB9APKMPLA2G7KMT2A
Biphenyl SCHEMBL7938918 0.80 GAA (0.46) KMT2ALMNAF2MAPTMEN1
SCHEMBL8717537 0.79 LMNA (0.67) KMT2APOLBLMNAF2MAPT

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
WO-2024010056-A1 SECONDARY BATTERY ダイキン工業株式会社 2024-01-11 — — WO disclosed
WO-2024010057-A1 NEGATIVE ELECTRODE, BATTERY, AND METHOD FOR COVERING BATTERY MATERIAL ダイキン工業株式会社 2024-01-11 — — WO disclosed
WO-2023249003-A1 SURFACE TREATMENT AGENT FOR ELECTRODE MATERIAL, POSITIVE ELECTRODE ACTIVE MATERIAL, CURRENT COLLECTOR FOIL, NEGATIVE ELECTRODE ACTIVE MATERIAL, CONDUCTIVE AID, ELECTRODE, BATTERY, METHOD FOR MANUFACTURING POSITIVE ELECTRODE ACTIVE MATERIAL, METHOD FOR MANUFACTURING CURRENT COLLECTOR FOIL, METHOD FOR MANUFACTURING NEGATIVE ELECTRODE ACTIVE MATERIAL, METHOD FOR MANUFACTURING CONDUCTIVE AID, AND METHOD FOR MANUFACTURING ELECTRODE ダイキン工業株式会社 2023-12-28 — — WO disclosed
WO-2023238909-A1 ELECTROLYTE SOLUTION AND SECONDARY BATTERY USING SAME ダイキン工業株式会社 2023-12-14 — — WO disclosed
WO-2023167196-A1 ELECTRODE ACTIVE MATERIAL, ELECTRODE, ELECTROCHEMICAL DEVICE, MODULE AND METHOD 国立大学法人京都大学 2023-09-07 — — WO disclosed
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