SCHEMBL6281119

SCHEMBL6281119

COc1ccccc1-c1ccc(-c2ccc(C(N)=O)cc2)c(C)c1C(N)=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 2/20 0.50
CAMKK2 Q96RR4 2/20 0.50
FYN P06241 1/20 0.50
CHUK O15111 1/20 0.50
INSR P06213 1/20 0.50
MKNK1 Q9BUB5 3/20 0.46
MKNK2 Q9HBH9 3/20 0.46
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CHEK1 O14757 2/20 0.43
CHEK2 O96017 2/20 0.43
ALDH1A1 P00352 1/20 0.43
POLB P06746 1/20 0.43
PDE4A P27815 2/20 0.43
PDE4B Q07343 2/20 0.43
PDE4C Q08493 2/20 0.43
PDE4D Q08499 2/20 0.43
CA1 P00915 1/20 0.41
CA2 P00918 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
SCHEMBL2967361 0.85 MAPK8 (0.58) MAPK8CAMKK2FYNCHUKINSR
SCHEMBL9540301 0.76 IKBKB (0.46) RAB9ASMN1; SMN2L3MBTL1ALDH1A1PARP1
Hydrochloric Acid SCHEMBL26632024 0.75 MKNK1 (0.46) CHUKMKNK1MKNK2SMN1; SMN2CA1
SCHEMBL21246919 0.73 PTPRC (0.51) RAB9AL3MBTL1ALDH1A1PTPRCPTPN1
SCHEMBL6634531 0.72 CA12 (0.55) SMN1; SMN2L3MBTL1ALDH1A1POLBCA1
SCHEMBL28264223 0.72 MKNK1 (0.61) CAMKK2MKNK1MKNK2RAB9AL3MBTL1
SCHEMBL1222758 0.71 RXRA (0.58) ALDH1A1PDE4APDE4BPDE4CPDE4D
SCHEMBL12189290 0.71 L3MBTL1 (0.60) SMN1; SMN2L3MBTL1ALDH1A1PTPRCPTPN1
SCHEMBL3898826 0.71 MKNK1 (0.57) CAMKK2MKNK1MKNK2L3MBTL1CHEK2
SCHEMBL2950525 0.71 MKNK1 (0.60) MKNK1MKNK2RAB9AL3MBTL1CHEK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1608616-A1 BIPHENYL CARBOXYLIC AMIDE P38 KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2005-12-28 EP disclosed
WO-2004089874-A1 BIPHENYL CARBOXYLIC AMIDE P38 KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2004-10-21 WO disclosed