SCHEMBL4865403

SCHEMBL4865403

Cc1nnc(-c2ccc(C)c(Br)c2)o1.Cc1nnc(-c2ccc(C)c(Br)c2)o1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.49
RAB9A P51151 5/20 0.49
SMN1; SMN2 Q16637 4/20 0.45
GAA P10253 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
KDM4E B2RXH2 1/20 0.45
MAPT P10636 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
NOTUM Q6P988 1/20 0.44
MAPK14 Q16539 7/20 0.44
MAP2K1 Q02750 1/20 0.44
LMNA P02545 2/20 0.44
ALDH1A1 P00352 2/20 0.44
HPGD P15428 1/20 0.44
HTT P42858 1/20 0.44
MAOB P27338 1/20 0.43
MAPK11 Q15759 1/20 0.42
GPR84 Q9NQS5 1/20 0.42
TSHR P16473 1/20 0.41

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
SCHEMBL4863208 1.00 NPC1 (0.49) NPC1RAB9ASMN1; SMN2GAAMEN1
SCHEMBL5113396 0.86 RAB9A (0.45) NPC1RAB9ASMN1; SMN2GAAMEN1
SCHEMBL26128233 0.84 LRRK2 (0.45) NPC1RAB9ASMN1; SMN2GAAMEN1
SCHEMBL31243652 0.84 LRRK2 (0.45) NPC1RAB9ASMN1; SMN2GAAMEN1
SCHEMBL12918687 0.83 ALDH1A1 (0.53) NPC1RAB9ASMN1; SMN2MAPTNPSR1
SCHEMBL8229635 0.83 NOTUM (0.46) NPC1RAB9ASMN1; SMN2GAAMEN1
SCHEMBL22085182 0.83 NPC1 (0.47) NPC1RAB9ASMN1; SMN2GAAMEN1
SCHEMBL3617076 0.81 NPC1 (0.56) NPC1RAB9ASMN1; SMN2GAAMEN1
SCHEMBL29133006 0.80 KDM4E (0.52) NPC1RAB9ASMN1; SMN2GAAMEN1
SCHEMBL30622241 0.80 KDM4E (0.52) NPC1RAB9ASMN1; SMN2GAAMEN1

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 5 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
US-7166623-B2 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) 2007-01-23 US disclosed
US-20050090491-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) 2005-04-28 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050090491-A1 2'-Methyl-5'-(1,3,4-oxadiazol-2-yl)-1,1'-biphenyl-4-carboxamide derivatives and their use as p38 kinase inhibitors GRK4, MAPK4, MAPK1 NPC1 3562/4885RAB9A 3417/4885SMN1; SMN2 2056/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.