SCHEMBL7103825

SCHEMBL7103825

[CH2]CCCc1nc(-c2cncnc2)c[nH]1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HASPIN Q8TF76 1/20 0.31
MAPK1 P28482 1/20 0.30

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
SCHEMBL455756 0.82 MAPK1 (0.42) MAPK1
SCHEMBL453941 0.81
SCHEMBL4861987 0.81 GSK3B (0.43) HASPINMAPK1
SCHEMBL5673498 0.79 SMN1; SMN2 (0.36) MAPK1
SCHEMBL7686070 0.72 MAPK1 (0.43) MAPK1
SCHEMBL15453284 0.70 GSK3B (0.39) MAPK1
SCHEMBL1133233 0.67 CYP2A6 (0.47) MAPK1
SCHEMBL5677776 0.66 MAPK1 (0.34) MAPK1
SCHEMBL455665 0.66 PDGFRB (0.51) MAPK1
SCHEMBL2323022 0.66 HRH1 (0.48) MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1171447-A2 KETOLIDE ANTIBACTERIALS Ortho-McNeil Pharmaceutical, Inc. (US) 2002-01-16 EP claimed
WO-2000062783-A2 KETOLIDE ANTIBACTERIALS ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2000-10-26 WO claimed
EP-1345953-A2 KETOLIDE ANTIBACTERIALS Ortho-Mcneil Pharmaceutical, Inc. (US) 2003-09-24 EP disclosed
WO-2002032918-A2 KETOLIDE ANTIBACTERIALS ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2002-04-25 WO disclosed
EP-1171447-A2 KETOLIDE ANTIBACTERIALS Ortho-McNeil Pharmaceutical, Inc. (US) 2002-01-16 EP disclosed
WO-2000062783-A2 KETOLIDE ANTIBACTERIALS ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2000-10-26 WO disclosed