SCHEMBL777302

SCHEMBL777302

Cc1ccc(C(=O)P(=O)(O)Oc2ccccc2C)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
LMNA P02545 3/20 0.46
MAPT P10636 3/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
CRHBP P24387 1/20 0.46
CRHR2 Q13324 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
RAB9A P51151 2/20 0.43
POLB P06746 2/20 0.41
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
NPSR1 Q6W5P4 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
RXRA P19793 1/20 0.40
RXRB P28702 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
SCHEMBL779807 0.84 RAB9A (0.40) ALDH1A1LMNAMAPTMEN1KMT2A
SCHEMBL778355 0.81 SRC (0.41) ALDH1A1LMNAMAPTMEN1KMT2A
SCHEMBL778117 0.81 HPGD (0.45) ALDH1A1MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL778424 0.78 KDM4E (0.41) ALDH1A1LMNAMAPTMEN1KMT2A
SCHEMBL28696137 0.78 TDP1 (0.43) ALDH1A1LMNAMAPTMEN1KMT2A
SCHEMBL777185 0.77 PTGDR2 (0.46) ALDH1A1LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL3887624 0.76 LMNA (0.47) ALDH1A1LMNAMAPTMEN1KMT2A
Toluene SCHEMBL28427945 0.75 GPR84 (0.44) ALDH1A1LMNAMAPTMEN1KMT2A
SCHEMBL4454749 0.74 NPSR1 (0.44) ALDH1A1LMNAMAPTMEN1KMT2A
SCHEMBL779557 0.74 ALDH1A1 (0.40) ALDH1A1LMNAMAPTMEN1KMT2A

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