SCHEMBL775479

SCHEMBL775479

Cc1cccc(C(=O)OS(=O)Oc2ccccc2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.46
MAPT P10636 3/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
GAA P10253 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
ALDH1A1 P00352 2/20 0.45
POLB P06746 4/20 0.44
PARP1 P09874 1/20 0.44
KMT2A Q03164 6/20 0.43
ESR1 P03372 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MAPK1 P28482 1/20 0.43
MEN1 O00255 4/20 0.42
KCNK3 O14649 2/20 0.42
KCNK9 Q9NPC2 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ESR2 Q92731 1/20 0.42
LMNA P02545 2/20 0.41

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
SCHEMBL779993 0.86 PARP1 (0.53) SMN1; SMN2MAPTCYP1A2CYP3A4GAA
SCHEMBL776891 0.83 RAB9A (0.46) SMN1; SMN2MAPTALDH1A1POLBKMT2A
SCHEMBL777089 0.81 PARP1 (0.49) SMN1; SMN2MAPTCYP1A2CYP3A4GAA
SCHEMBL6057124 0.78 KMT2A (0.64) SMN1; SMN2MAPTCYP1A2CYP3A4GAA
SCHEMBL30342901 0.78 KMT2A (0.64) SMN1; SMN2MAPTCYP1A2CYP3A4GAA
SCHEMBL776896 0.78 TDP1 (0.46) POLBPARP1KMT2AESR1MEN1
SCHEMBL3883005 0.77 ACHE (0.50) SMN1; SMN2MAPTGAAALDH1A1KMT2A
Benzoyl Peroxide SCHEMBL10925823 0.74 F2 (0.65) SMN1; SMN2MAPTALDH1A1POLBPARP1
SCHEMBL329271 0.74 F2 (0.65) SMN1; SMN2MAPTALDH1A1POLBPARP1
SCHEMBL6113333 0.74 SMN1; SMN2 (0.58) SMN1; SMN2MAPTALDH1A1POLBPARP1

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