SCHEMBL11724977

SCHEMBL11724977

CCCC1NC(=O)N(c2cc(Cl)cc(Cl)c2)C1=O

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
TSHR P16473 1/20 0.37
SIRT2 Q8IXJ6 1/20 0.33
ADAMTS5 Q9UNA0 2/20 0.33
ADAM10 O14672 1/20 0.33
ADAMTS4 O75173 1/20 0.33
MMP12 P39900 1/20 0.33
ADAM17 P78536 1/20 0.33
ADAM9 Q13443 1/20 0.33
ITGAL P20701 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HSD17B10 Q99714 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32
TAS2R8 Q9NYW2 1/20 0.32
GAA P10253 1/20 0.32
ITGA4 P13612 1/20 0.32
ITGB7 P26010 1/20 0.32
BCL2A1 Q16548 1/20 0.31

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
SCHEMBL13879485 0.91 MEN1 (0.39) MEN1KMT2ATSHRSIRT2ALDH1A1
SCHEMBL11612934 0.83 KMT2A (0.58) MEN1KMT2ATSHRALDH1A1GAA
SCHEMBL17206979 0.79 GAA (0.51) MEN1KMT2AALDH1A1NPSR1GAA
SCHEMBL13879452 0.78 ALDH1A1 (0.54) MEN1KMT2AALDH1A1TAS2R8GAA
SCHEMBL13879400 0.77 GRM2 (0.44) ALDH1A1NPSR1
SCHEMBL13879506 0.77 GRM2 (0.47) MEN1KMT2AALDH1A1
SCHEMBL5238330 0.74 TSHR (0.42) MEN1KMT2ATSHRITGALALDH1A1
SCHEMBL13879529 0.73 TAS2R8 (0.47) TSHRALDH1A1HSD17B10TAS2R8
SCHEMBL13879463 0.70 LMNA (0.52) MEN1KMT2ATSHRADAMTS5ADAM17
SCHEMBL11612896 0.70 KMT2A (0.48) MEN1KMT2AALDH1A1GAA

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
US-4056622-A MICROBIOCIDES, FUNGICIDES, BACTERICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1977-11-01 US disclosed