SCHEMBL7989925

SCHEMBL7989925

O=C(O)c1nc(-c2ccc(Cl)cc2)[nH]c1-c1ccncc1

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 13/20 0.62
MAPK13 O15264 12/20 0.62
MAPK12 P53778 12/20 0.62
MAPK11 Q15759 12/20 0.62
GCGR P47871 9/20 0.62
RAF1 P04049 5/20 0.60
ALOX5 P09917 1/20 0.51
TGFBR1 P36897 1/20 0.51
BRAF P15056 1/20 0.48
CHEK2 O96017 1/20 0.48
KDM4E B2RXH2 1/20 0.48
NPC1 O15118 1/20 0.48
ALDH1A1 P00352 1/20 0.48
PKM P14618 1/20 0.48
HPGD P15428 1/20 0.48
RAB9A P51151 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL7992089 0.87 MAPK14 (0.62) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL7977738 0.86 MAPK14 (0.56) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL7992039 0.86 MAPK14 (0.56) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL7992159 0.86 MAPK14 (0.68) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL8312008 0.85 MAPK14 (0.61) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL7995390 0.85 MAPK14 (0.48) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL7991890 0.83 BRAF (0.48) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL7995219 0.82 RHEB (0.48) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL7995495 0.82 MAPK13 (0.63) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL15075613 0.82 MAPK13 (0.63) MAPK14MAPK13MAPK12MAPK11GCGR

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-6288061-B1 INTERLEUKIN INHIBITORS; ASTHMA, BRONCHODILATOR AGENTS, ANTIALLERGENS WELFIDE CORPORATION (JP) 2001-09-11 US disclosed