SCHEMBL777428

SCHEMBL777428

Cc1ccccc1C(=O)OP(=O)(C(=O)c1ccccc1C)C(=O)c1ccccc1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.44
RAB9A P51151 5/20 0.44
HPGD P15428 2/20 0.43
KMT2A Q03164 7/20 0.43
MAPT P10636 3/20 0.43
LMNA P02545 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HTT P42858 1/20 0.43
MEN1 O00255 5/20 0.42
ESR1 P03372 1/20 0.42
ESR2 Q92731 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.40
PLK1 P53350 1/20 0.40
PLK2 Q9NYY3 1/20 0.40
CASP3 P42574 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
GAA P10253 1/20 0.40
TSHR P16473 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
SCHEMBL779208 0.86 KMT2A (0.46) NPC1RAB9AHPGDKMT2AMAPT
SCHEMBL6006322 0.81 NPC1 (0.46) NPC1RAB9AHPGDKMT2AMAPT
SCHEMBL781190 0.81 NPC1 (0.46) NPC1RAB9AHPGDKMT2AMAPT
SCHEMBL570344 0.81 NPC1 (0.46) NPC1RAB9AHPGDKMT2AMAPT
SCHEMBL30292582 0.79 NPC1 (0.47) NPC1RAB9AHPGDKMT2AMAPT
SCHEMBL28158096 0.79 NPC1 (0.44) NPC1RAB9AHPGDKMT2AMAPT
SCHEMBL776959 0.78 NPC1 (0.46) NPC1RAB9AHPGDKMT2AMAPT
SCHEMBL778657 0.77 KMT2A (0.51) NPC1RAB9AHPGDKMT2AMAPT
SCHEMBL443122 0.77 HPGD (0.52) NPC1RAB9AHPGDKMT2AMAPT
SCHEMBL2258548 0.77 HPGD (0.52) NPC1RAB9AHPGDKMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-20120177988-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2012-07-12 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