SCHEMBL778566

SCHEMBL778566

Cc1ccc(C(=O)C(CCCP(=O)(O)O)c2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.47
HSD17B10 Q99714 1/20 0.47
PTPN1 P18031 1/20 0.41
ALDH1A1 P00352 2/20 0.41
TP53 P04637 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
POLB P06746 1/20 0.40
GAA P10253 1/20 0.40
HTT P42858 1/20 0.40
NPSR1 Q6W5P4 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
CYP3A4 P08684 2/20 0.39
CYP2C19 P33261 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39

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
SCHEMBL778604 0.83 LMNA (0.51) LMNAHSD17B10PTPN1ALDH1A1TP53
SCHEMBL777296 0.83 CHRM2 (0.47) LMNAALDH1A1SMN1; SMN2GAACES2
SCHEMBL777250 0.81 ACP3 (0.42) SMN1; SMN2ACP3
SCHEMBL3883994 0.80 HTR2A (0.50) ALDH1A1MEN1KMT2AACP3
SCHEMBL12135182 0.76 LMNA (0.76) LMNAHSD17B10ALDH1A1TP53SMN1; SMN2
SCHEMBL23865436 0.76 LMNA (0.50) LMNAHSD17B10ALDH1A1TP53SMN1; SMN2
SCHEMBL780486 0.75 LMNA (0.48) LMNAALDH1A1TP53SMN1; SMN2POLB
SCHEMBL28791748 0.75 TBXAS1 (0.48) ALDH1A1POLBMEN1KMT2ACYP2C19
SCHEMBL11655496 0.73 LMNA (0.57) LMNAHSD17B10ALDH1A1TP53SMN1; SMN2
SCHEMBL11521612 0.73 POLB (0.58) LMNAHSD17B10ALDH1A1SMN1; SMN2POLB

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