SCHEMBL6647299

SCHEMBL6647299

O=c1[nH]cc(Cc2cccc(F)c2)c(O)c1Br

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DAO P14920 5/20 0.52
PDE3B Q13370 1/20 0.43
PDE3A Q14432 1/20 0.43
HCAR2 Q8TDS4 1/20 0.41
SNCA P37840 2/20 0.39
KDM4E B2RXH2 1/20 0.39
HSD17B10 Q99714 1/20 0.39
IDH1 O75874 1/20 0.39

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
SCHEMBL6650193 0.81 DAO (0.43) DAOPDE3BPDE3ASNCA
SCHEMBL6652310 0.77 MAPK14 (0.47) DAOPDE3BPDE3A
SCHEMBL5215190 0.76 DAO (0.49) DAOPDE3BPDE3ASNCA
SCHEMBL6471595 0.75 DAO (0.39) DAOPDE3BPDE3A
SCHEMBL6649147 0.74 PKM (0.45) DAOKDM4E
SCHEMBL6648289 0.74 MAOB (0.43) DAOPDE3BPDE3A
SCHEMBL6648037 0.74 THRA (0.41) DAOPDE3BPDE3AKDM4E
SCHEMBL6653308 0.74 PDE3B (0.38) DAOPDE3BPDE3A
SCHEMBL6652379 0.74 KMT2A (0.41) DAOPDE3BPDE3A
SCHEMBL6471288 0.74 DAO (0.38) DAOPDE3BPDE3AHCAR2SNCA

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-1490064-A1 SUBSTITUTED PYRIDINONES AS MODULATORS OF P38 MAP KINASE Pharmacia Corporation (US) 2004-12-29 EP disclosed
WO-2003068230-A1 SUBSTITUTED PYRIDINONES AS MODULATORS OF P38 MAP KINASE PHARMACIA CORPORATION (US) 2003-08-21 WO disclosed