SCHEMBL7024907

SCHEMBL7024907

Cn1ccc2[nH]c(=O)n(CCC(S)CS)c(=O)c21

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
QPCT Q16769 1/20 0.33
MPO P05164 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
CYP1A2 P05177 1/20 0.32
CRBN Q96SW2 1/20 0.32

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
SCHEMBL7024912 1.00 QPCT (0.33) QPCTMPOALDH1A1HPGDCYP1A2
SCHEMBL7020008 0.88 CYP1A2 (0.33) MPOCYP1A2CRBN
SCHEMBL7020004 0.88 CYP1A2 (0.33) MPOCYP1A2CRBN
SCHEMBL7012482 0.75 ADORA3 (0.33) QPCTMPOALDH1A1HPGDCYP1A2
SCHEMBL7016350 0.75 BRD4 (0.32)
SCHEMBL7012478 0.75 ADORA3 (0.33) QPCTMPOALDH1A1HPGDCYP1A2
SCHEMBL7016348 0.75 BRD4 (0.32)
SCHEMBL7019026 0.74 CYP1A2 (0.32) CYP1A2CRBN
SCHEMBL7019031 0.74 CYP1A2 (0.32) CYP1A2CRBN
SCHEMBL7020738 0.72

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-1357114-A1 Substituted pyrimidin-2,4(1H,3H)-diones as inhibitors of Matrix Metalloproteinases (MMP) IBFB GmbH Privates Institut für biomedizinische Forschung und Beratung (DE) 2003-10-29 EP disclosed