SCHEMBL4738183

SCHEMBL4738183

CCCS(=O)(=O)Oc1ccc(C2(c3ccc(F)c(Br)c3)C(=O)NC(=S)N2C)cc1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 7/20 0.33
LMNA P02545 1/20 0.33
CA12 O43570 2/20 0.33
CA2 P00918 2/20 0.33
MMP9 P14780 6/20 0.32
MMP14 P50281 2/20 0.32
MMP7 P09237 1/20 0.32
ENPP3 O14638 1/20 0.30
ENPP1 P22413 1/20 0.30
ENPP2 Q13822 1/20 0.30

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
SCHEMBL4735344 0.92 ADORA2B (0.30)
SCHEMBL4734992 0.89 MMP2 (0.31) MMP2MMP9
SCHEMBL4737143 0.85 TDP1 (0.38) MMP2LMNACA12CA2MMP9
SCHEMBL4734175 0.82 MMP2 (0.31) MMP2LMNAMMP9
SCHEMBL4733449 0.81 CNR1 (0.41) LMNACA12CA2
SCHEMBL4733748 0.80
SCHEMBL4736890 0.80
SCHEMBL4737594 0.78 ALDH1A1 (0.38)
SCHEMBL5066204 0.78 LMNA (0.32) MMP2LMNA
SCHEMBL4805989 0.77 ALDH1A1 (0.32) LMNA

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
WO-2008076046-A1 NOVEL 2-AMINO-5, 5-DIARYL-IMIDAZOL-4-ONES ASTRAZENECA AB (SE) 2008-06-26 WO disclosed