SCHEMBL1707571

SCHEMBL1707571

Cc1cccc(C(=O)NC(=S)Nc2ccc(NC(=O)CCCCN(C)C)cc2)c1

nearest known ligand 0.79

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 18/20 0.79
SIRT1 Q96EB6 15/20 0.79
SIRT3 Q9NTG7 1/20 0.67

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
SCHEMBL16229476 0.88 ALDH1A1 (0.68) SIRT2SIRT1
Hydrochloric Acid SCHEMBL1706807 0.88 SIRT2 (1.00) SIRT2SIRT1
Hydrochloric Acid SCHEMBL1707574 0.88 SIRT2 (0.78) SIRT2SIRT1SIRT3
SCHEMBL17826582 0.87 ALDH1A1 (0.64) SIRT2SIRT1
Hydrochloric Acid SCHEMBL1707575 0.87 SIRT2 (0.80) SIRT2SIRT1SIRT3
Hydrochloric Acid SCHEMBL1708333 0.86 SIRT2 (0.78) SIRT2SIRT1SIRT3
Hydrochloric Acid SCHEMBL1707948 0.86 SIRT2 (0.82) SIRT2SIRT1SIRT3
Hydrochloric Acid SCHEMBL1706648 0.85 SIRT2 (0.81) SIRT2SIRT1SIRT3
Hydrochloric Acid SCHEMBL1707513 0.82 SIRT2 (0.83) SIRT2SIRT1SIRT3
Hydrochloric Acid SCHEMBL1707443 0.82 SIRT2 (0.98) SIRT2SIRT1SIRT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2440522-A2 AROYLTHIOUREA AND ARYLTHIOCARBONYLUREA DERIVATIVES University Court of The University of Dundee (GB) 2012-04-18 EP disclosed