SCHEMBL5422370

SCHEMBL5422370

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

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 1.00
▸ SMN1; SMN2 Q16637 2/20 1.00
▸ LMNA P02545 3/20 0.72
▸ ALDH1A1 P00352 6/20 0.61
▸ ALOX15 P16050 3/20 0.61
▸ HSD17B10 Q99714 2/20 0.61
▸ KDM4E B2RXH2 1/20 0.61
▸ CASP1 P29466 1/20 0.61
▸ CASP7 P55210 1/20 0.61
▸ MAPT P10636 11/20 0.59
▸ MEN1 O00255 7/20 0.59
▸ KMT2A Q03164 7/20 0.59
▸ MAPK1 P28482 5/20 0.57
▸ HTT P42858 3/20 0.55
▸ OPRM1 P35372 1/20 0.55
▸ OPRD1 P41143 1/20 0.55
▸ CLK1 P49759 1/20 0.55
▸ USP2 O75604 1/20 0.54
▸ TP53 P04637 1/20 0.54
▸ L3MBTL1 Q9Y468 1/20 0.52

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
SCHEMBL30270516 0.84 LMNA (1.00) POLBSMN1; SMN2LMNAALDH1A1ALOX15
SCHEMBL5912909 0.84 LMNA (0.78) POLBSMN1; SMN2LMNAALDH1A1ALOX15
SCHEMBL2636675 0.84 LMNA (1.00) POLBSMN1; SMN2LMNAALDH1A1ALOX15
SCHEMBL18618415 0.83 LMNA (0.72) POLBSMN1; SMN2LMNAALDH1A1ALOX15
SCHEMBL24124207 0.83 LMNA (0.76) POLBSMN1; SMN2LMNAALDH1A1ALOX15
SCHEMBL30270575 0.83 LMNA (0.76) POLBSMN1; SMN2LMNAALDH1A1ALOX15
SCHEMBL8551997 0.83 POLB (0.70) POLBSMN1; SMN2LMNAALDH1A1ALOX15
SCHEMBL7488353 0.82 POLB (0.70) POLBSMN1; SMN2LMNAALDH1A1ALOX15
SCHEMBL25920701 0.81 POLB (0.67) POLBSMN1; SMN2LMNAALDH1A1ALOX15
SCHEMBL10651410 0.80 LMNA (0.71) POLBSMN1; SMN2LMNAALDH1A1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160318933-A1 FUSED PYRAZOLE DERIVATIVE SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2016-11-03 — — 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-7179922-B2 4-Phenyloxypiperidionopiperidine compounds as antiinflammatory agents; autoimmune diseases; rheumatic diseases; cardiovascular disorders ASTRAZENECA AB (SE) 2007-02-20 — — US disclosed
US-20050171092-A1 Chemical compounds ASTRAZENECA AB, A SWEDEN CORPORATION 2005-08-04 — — US disclosed
EP-1274701-B1 [1,4']-BIPIPERIDINE COMPOUNDS ASTRAZENECA AB (SE) 2005-06-29 — — EP disclosed
US-6903115-B2 Bipiperidine compounds ASTRAZENECA AB (SE) 2005-06-07 — — US disclosed
EP-1493743-A1 Substituted bipiperidine intermediates and derivatives thereof AstraZeneca AB (SE) 2005-01-05 — — EP disclosed
US-20040014783-A1 Chemical compounds ASTRAZENECA AB, A SWEDEN CORPORATION 2004-01-22 — — US disclosed
US-20040006080-A1 Chemical compounds ASTRAZENECA AB, A SWEDEN CORPORATION 2004-01-08 — — 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 (6 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 POLB 3341/4885SMN1; SMN2 3613/4885LMNA 4160/4885
US-20160318933-A1 FUSED PYRAZOLE DERIVATIVE DRD4, DRD2, DRD3 POLB 3812/4885SMN1; SMN2 2784/4885LMNA 4883/4885
US-20050171092-A1 Chemical compounds CCR3, CCR1, CCR4 POLB 3244/4885SMN1; SMN2 3709/4885LMNA 3860/4885
US-20040006080-A1 Chemical compounds CCR3, CCR1, CCR4 POLB 3341/4885SMN1; SMN2 3613/4885LMNA 4160/4885
US-20040014783-A1 Chemical compounds CCR3, CCR1, CCR4 POLB 3341/4885SMN1; SMN2 3613/4885LMNA 4160/4885
US-20070179297-A1 Chemical compounds CCR3, CCR1, CCR4 POLB 3244/4885SMN1; SMN2 3709/4885LMNA 3860/4885

“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.

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