SCHEMBL2057595

SCHEMBL2057595

CC(COS(=O)(=O)c1ccccc1)(COS(=O)(=O)c1ccccc1)COS(=O)(=O)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PSIP1 O75475 1/20 0.43
PARL Q9H300 1/20 0.43
ALDH1A1 P00352 5/20 0.42
HSD11B1 P28845 1/20 0.42
ATM Q13315 2/20 0.41
HTR6 P50406 2/20 0.39
TDP1 Q9NUW8 3/20 0.39
GAA P10253 1/20 0.38
MCOLN3 Q8TDD5 1/20 0.38
KDM4E B2RXH2 2/20 0.38
MAPT P10636 2/20 0.38
HPGD P15428 1/20 0.38
KMT2A Q03164 1/20 0.38
POLB P06746 1/20 0.38
GLA P06280 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
CYP2C19 P33261 1/20 0.38
HSD17B10 Q99714 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
SCHEMBL16045568 0.91 PSIP1 (0.44) PSIP1PARLALDH1A1HSD11B1ATM
SCHEMBL3447252 0.90 PSIP1 (0.45) PSIP1PARLALDH1A1HSD11B1ATM
SCHEMBL5590961 0.88 PSIP1 (0.43) PSIP1PARLALDH1A1HSD11B1ATM
SCHEMBL2058282 0.83 PARL (0.46) PSIP1PARLALDH1A1HSD11B1HTR6
SCHEMBL3448335 0.83 HSD11B1 (0.42) PSIP1PARLALDH1A1HSD11B1ATM
SCHEMBL16053872 0.83 HTR6 (0.40) PSIP1PARLALDH1A1HSD11B1ATM
SCHEMBL476998 0.82 PSIP1 (0.47) PSIP1PARLALDH1A1HSD11B1ATM
SCHEMBL2057211 0.82 ALDH1A1 (0.46) ALDH1A1GAAKMT2ACYP2C19
SCHEMBL22265083 0.82 PARL (0.39) PSIP1PARLALDH1A1HSD11B1ATM
SCHEMBL11049643 0.82 PARL (0.44) PSIP1PARLALDH1A1HSD11B1HTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9065146-B2 Nonaqueous electrolyte and lithium secondary battery employing the same MITSUBISHI CHEMICAL CORPORATION (JP) 2015-06-23 US disclosed
US-8551662-B2 Nonaqueous electrolyte and lithium secondary battery employing the same MITSUBISHI CHEMICAL CORPORATION (JP) 2013-10-08 US disclosed
US-8404802-B2 a targeting vector which binds to receptors associated with integrin receptors, angiogenesis; contrast agents; diagnosis of malignant diseases, heart diseases, inflammation-related diseases, rheumatoid arthritis and Kaposi's sarcoma GE HEALTHCARE AS (NO) 2013-03-26 US disclosed
US-8029935-B2 Nonaqueous electrolyte and lithium secondary battery employing the same MITSUBISHI CHEMICAL CORPORATION (JP) 2011-10-04 US disclosed
US-20110229771-A1 NONAQUEOUS ELECTROLYTE AND LITHIUM SECONDARY BATTERY EMPLOYING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2011-09-22 US disclosed
US-7981553-B2 Nonaqueous electrolyte and lithium secondary battery employing the same MITSUBISHI CHEMICAL CORPORATION (JP) 2011-07-19 US disclosed
US-20110159380-A1 NONAQUEOUS ELECTROLYTE AND LITHIUM SECONDARY BATTERY EMPLOYING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2011-06-30 US disclosed
US-20100227226-A1 NONAQUEOUS ELECTROLYTE AND LITHIUM SECONDARY BATTERY EMPLOYING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2010-09-09 US disclosed
US-20100021823-A1 NONAQUEOUS ELECTROLYTE AND LITHIUM SECONDARY BATTERY EMPLOYING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2010-01-28 US disclosed
US-7575833-B2 Nonaqueous electrolyte and lithium secondary battery employing the same MITSUBISHI CHEMICAL CORPORATION (JP) 2009-08-18 US disclosed
US-20080187493-A1 a targeting vector which binds to receptors associated with integrin receptors, angiogenesis; contrast agents; diagnosis of malignant diseases, heart diseases, inflammation-related diseases, rheumatoid arthritis and Kaposi's sarcoma GE HEALTHCARE AS (NO) 2008-08-07 US disclosed
US-7351790-B2 Peptide-based compounds GE HEALTHCARE AS (NO) 2008-04-01 US disclosed
US-20070238025-A1 NONAQUEOUS ELECTROLYTE AND LITHIUM SECONDARY BATTERY EMPLOYING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2007-10-11 US disclosed
US-7223502-B2 Nonaqueous electrolyte and lithium secondary battery employing the same MITSUBISHI CHEMICAL CORPORATION (JP) 2007-05-29 US disclosed
EP-1272507-B1 INTEGRIN BINDING PEPTIDE DERIVATIVES AMERSHAM HEALTH AS (NO) 2005-06-29 EP disclosed
US-20050118512-A1 Nonaqueous electrolyte and lithium secondary battery employing the same MITSUBISHI CHEMICAL CORPORATION (JP) 2005-06-02 US disclosed
US-20030204049-A1 Peptide-based compounds GE HEALTHCARE LIMITED (GB) 2003-10-30 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030204049-A1 Peptide-based compounds ITGB3, ITGAV, SELPLG PSIP1 1461/4885PARL 1738/4885ALDH1A1 4667/4885
US-20080187493-A1 a targeting vector which binds to receptors associated with integrin receptors, angiogenesis; contrast agents; diagnosis of malignant diseases, heart diseases, inflammation-related diseases, rheumatoid arthritis and Kaposi's sarcoma KDR, VCAM1, FLT1 PSIP1 2507/4885PARL 4469/4885ALDH1A1 3531/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.