SCHEMBL780574

SCHEMBL780574

CC(=CP(=O)(O)O)C(=O)c1ccccc1C

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.42
HPGD P15428 2/20 0.42
KDM4E B2RXH2 1/20 0.41
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
PLAU P00749 1/20 0.39
ELANE P08246 1/20 0.39
GPR52 Q9Y2T5 1/20 0.39
POLB P06746 1/20 0.38
KMT2A Q03164 1/20 0.38
TYK2 P29597 1/20 0.38
ERCC5 P28715 1/20 0.38
FEN1 P39748 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
TP53 P04637 1/20 0.37
MAPK1 P28482 1/20 0.37

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
SCHEMBL3884833 0.80 SMN1; SMN2 (0.42) SMN1; SMN2HPGDKDM4ENPC1RAB9A
SCHEMBL778666 0.79 HPGD (0.42) SMN1; SMN2HPGDKDM4ENPC1RAB9A
SCHEMBL777437 0.79 SMN1; SMN2 (0.40) SMN1; SMN2HPGDKDM4ENPC1RAB9A
SCHEMBL777685 0.75 HPGD (0.41) SMN1; SMN2HPGDKDM4ENPC1RAB9A
SCHEMBL166603 0.74 HPGD (0.54) SMN1; SMN2HPGDKDM4EGPR52POLB
SCHEMBL29425530 0.74 HPGD (0.54) SMN1; SMN2HPGDKDM4EGPR52POLB
SCHEMBL780573 0.74 HPGD (0.43) SMN1; SMN2HPGDKDM4ENPC1RAB9A
SCHEMBL4865622 0.74 AKR1C3 (0.58) SMN1; SMN2HPGDKDM4ENPC1RAB9A
SCHEMBL16541189 0.73 SMN1; SMN2 (0.37) SMN1; SMN2HPGDKDM4ENPC1RAB9A
SCHEMBL3629099 0.73 CES2 (0.50) SMN1; SMN2HPGDKDM4EGPR52POLB

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