SCHEMBL5415041

SCHEMBL5415041

COC(=O)c1ccc2c(c1)N(C)C(=O)CS2(=O)=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.56
POLB P06746 1/20 0.56
CASP3 P42574 1/20 0.48
ALDH1A1 P00352 7/20 0.45
KDM4E B2RXH2 5/20 0.45
HSD17B10 Q99714 3/20 0.45
ALOX15 P16050 2/20 0.45
CASP1 P29466 1/20 0.45
CASP7 P55210 1/20 0.45
LMNA P02545 4/20 0.41
GAA P10253 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
XDH P47989 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
MAPT P10636 2/20 0.40
HPGD P15428 2/20 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
SCHEMBL8596033 0.83 CPT1A (0.45) SMN1; SMN2POLBCASP3ALDH1A1KDM4E
SCHEMBL8062935 0.78 ALDH1A1 (0.51) SMN1; SMN2POLBCASP3ALDH1A1KDM4E
SCHEMBL14427894 0.76 PDE3B (0.44) HSD17B10LMNACA12CA1CA2
SCHEMBL22757174 0.75 SMN1; SMN2 (0.60) SMN1; SMN2POLBCASP3ALDH1A1KDM4E
SCHEMBL21027869 0.74 VEGFA (0.47) SMN1; SMN2POLBCASP3ALDH1A1KDM4E
SCHEMBL21031908 0.73 ALDH1A1 (0.49) SMN1; SMN2POLBCASP3ALDH1A1KDM4E
SCHEMBL24233407 0.72 SMN1; SMN2 (0.60) SMN1; SMN2POLBCASP3ALDH1A1KDM4E
SCHEMBL3213901 0.72 SMN1; SMN2 (0.56) SMN1; SMN2POLBCASP3ALDH1A1KDM4E
SCHEMBL5422370 0.72 POLB (1.00) SMN1; SMN2POLBALDH1A1KDM4EHSD17B10
SCHEMBL5904274 0.71 PTPRC (0.47) SMN1; SMN2POLBCASP3ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070179297-A1 Chemical compounds ASTRAZENECA AB, A SWEDEN CORPORATION 2007-08-02 US disclosed
US-20070179297-A1 Chemical compounds ASTRAZENECA AB, A SWEDEN CORPORATION 2007-08-02 US disclosed
US-7238811-B2 Chemical compounds ASTRAZENECA AB (SE) 2007-07-03 US disclosed
US-7238811-B2 Chemical compounds ASTRAZENECA AB (SE) 2007-07-03 US disclosed
US-7179922-B2 4-Phenyloxypiperidionopiperidine compounds as antiinflammatory agents; autoimmune diseases; rheumatic diseases; cardiovascular disorders ASTRAZENECA AB (SE) 2007-02-20 US disclosed
US-7179922-B2 4-Phenyloxypiperidionopiperidine compounds as antiinflammatory agents; autoimmune diseases; rheumatic diseases; cardiovascular disorders ASTRAZENECA AB (SE) 2007-02-20 US disclosed
US-7179922-B2 4-Phenyloxypiperidionopiperidine compounds as antiinflammatory agents; autoimmune diseases; rheumatic diseases; cardiovascular disorders ASTRAZENECA AB (SE) 2007-02-20 US disclosed
US-6525070-B2 For therapy of chemokine (such as CCR3) or H1 mediated disease state ASTRAZENECA AB (SE) 2003-02-25 US disclosed
EP-1274701-A1 CHEMICAL COMPOUNDS AstraZeneca AB (SE) 2003-01-15 EP disclosed
US-20020077337-A1 Chemical compounds ASTRAZENECA AB (SE) 2002-06-20 US disclosed
WO-2001077101-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2001-10-18 WO 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-20020077337-A1 Chemical compounds CCR3, CCR1, CCR4 SMN1; SMN2 3613/4885POLB 3341/4885CASP3 1066/4885
US-20070179297-A1 Chemical compounds CCR3, CCR1, CCR4 SMN1; SMN2 3709/4885POLB 3244/4885CASP3 1053/4885

“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.