SCHEMBL241982

SCHEMBL241982

Cc1ccc(C(=O)NC2CC2)cc1NC(=O)c1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.68
HDAC8 Q9BY41 1/20 0.68
HDAC6 Q9UBN7 1/20 0.68
MAPK11 Q15759 18/20 0.68
MAPK14 Q16539 18/20 0.68
MAPK13 O15264 2/20 0.60
MAPK12 P53778 2/20 0.60

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
SCHEMBL240219 0.90 MAPK11 (0.65) MAPK11MAPK14MAPK13MAPK12
SCHEMBL243751 0.89 MAPK11 (0.70) MAPK11MAPK14MAPK13MAPK12
SCHEMBL240047 0.88 MAPK11 (0.64) MAPK11MAPK14MAPK13MAPK12
SCHEMBL1752529 0.88 MAPK11 (0.61) HDAC1HDAC8HDAC6MAPK11MAPK14
SCHEMBL3317398 0.88 NPC1 (0.67) HDAC1HDAC8HDAC6MAPK11MAPK14
SCHEMBL3314095 0.87 MAPK11 (0.57) HDAC1HDAC8HDAC6MAPK11MAPK14
SCHEMBL10090837 0.86 MAPK11 (0.58) HDAC1HDAC8HDAC6MAPK11MAPK14
SCHEMBL242627 0.85 CTDSP1 (0.58) MAPK11MAPK14
SCHEMBL239606 0.85 MAPK11 (0.67) MAPK11MAPK14MAPK13MAPK12
SCHEMBL239704 0.85 MAPK14 (0.65) MAPK11MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120004243-A1 AMIDE DERIVATIVES BEARING A CYCLOPROPYLAMINOACARBONYL SUBSTITUENT USEFUL AS CYTOKINE INHIBITORS ASTRAZENECA AB (SE) 2012-01-05 US claimed
EP-1699766-B1 AMIDE DERIVATIVES BEARING A CYCLOPROPYLAMINOACARBONYL SUBSTITUENT USEFUL AS CYTOKINE INHIBITORS ASTRAZENECA AB (SE) 2010-08-11 EP claimed
US-20070135440-A1 Amide derivatives bearing a cyclopropylaminoacarbonyl substituent useful as cytokine inhibitors ASTRAZENECA AB (SE) 2007-06-14 US claimed
US-20120004243-A1 AMIDE DERIVATIVES BEARING A CYCLOPROPYLAMINOACARBONYL SUBSTITUENT USEFUL AS CYTOKINE INHIBITORS ASTRAZENECA AB (SE) 2012-01-05 US disclosed
EP-1699766-B1 AMIDE DERIVATIVES BEARING A CYCLOPROPYLAMINOACARBONYL SUBSTITUENT USEFUL AS CYTOKINE INHIBITORS ASTRAZENECA AB (SE) 2010-08-11 EP disclosed
US-20070135440-A1 Amide derivatives bearing a cyclopropylaminoacarbonyl substituent useful as cytokine inhibitors ASTRAZENECA AB (SE) 2007-06-14 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-20070135440-A1 Amide derivatives bearing a cyclopropylaminoacarbonyl substituent useful as cytokine inhibitors IL2, IL6, IL1B HDAC1 84/4885HDAC8 393/4885HDAC6 51/4885
US-20120004243-A1 AMIDE DERIVATIVES BEARING A CYCLOPROPYLAMINOACARBONYL SUBSTITUENT USEFUL AS CYTOKINE INHIBITORS IL2, IL6, IL1B HDAC1 90/4885HDAC8 442/4885HDAC6 56/4885

“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.