SCHEMBL4866471

SCHEMBL4866471

Cc1ccc(C(=O)NNC(=O)OC(C)(C)C)cc1I.Cc1ccc(C(=O)NNC(=O)OC(C)(C)C)cc1I

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MTOR P42345 4/20 0.44
▸ ALDH1A1 P00352 2/20 0.39
▸ GAA P10253 2/20 0.39
▸ LCK P06239 5/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ LMNA P02545 1/20 0.38

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
SCHEMBL4864947 1.00 MTOR (0.44) MTORALDH1A1GAALCKSMN1; SMN2
SCHEMBL4865035 0.83 LMNA (0.54) MTORALDH1A1SMN1; SMN2KMT2ALMNA
SCHEMBL4865164 0.83 LMNA (0.54) MTORALDH1A1SMN1; SMN2KMT2ALMNA
SCHEMBL14159266 0.81 MTOR (0.47) MTORALDH1A1GAASMN1; SMN2KMT2A
SCHEMBL29715862 0.81 LCK (0.42) ALDH1A1GAALCKSMN1; SMN2KMT2A
SCHEMBL20703283 0.81 LCK (0.42) ALDH1A1GAALCKSMN1; SMN2KMT2A
SCHEMBL15006805 0.80 HDAC1 (0.42) ALDH1A1GAALCKSMN1; SMN2LMNA
SCHEMBL15007072 0.80 CHRNA1 (0.48) LCKSMN1; SMN2KMT2ALMNA
SCHEMBL4866468 0.80 MTOR (0.37) MTORKMT2ALMNA
SCHEMBL8279758 0.79 ALDH1A1 (0.51) ALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7384963-B2 2′-Methyl-5-(1,3,4-oxadiazol-2-yl)1, 1′-biphenyl-4-carboxaide derivatives and their use as p38 kinase GLAXO GROUP LIMITED (GB) 2008-06-10 — — US disclosed
EP-1435949-A1 2' -METHYL-5-(1,3,4-OXADIAZOL-2-YL)-1,1'-BIPHENYL-4-CARBOXAMIDE DERIVATIVES AND THEIR USE AS P38 KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2004-07-14 — — EP disclosed
WO-2003032986-A1 2' -METHYL-5-(1,3,4-OXADIAZOL-2-YL)-1,1'-BIPHENYL-4-CARBOXAMIDE DERIVATIVES AND THEIR USE AS P38 KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2003-04-24 — — WO disclosed
Send feedback