SCHEMBL9560515

SCHEMBL9560515

O=C(O)C1=Cn2ccc(=O)c3cccc(c32)O1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.32
TYMS P04818 1/20 0.31
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 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
SCHEMBL25374867 0.68
SCHEMBL18387317 0.64 ALDH1A1 (0.35) ALDH1A1LMNAMAPT
SCHEMBL11296259 0.60
SCHEMBL11869374 0.60 CHRM1 (0.45) ALDH1A1LMNA
SCHEMBL15263672 0.59 PAX8 (0.39) ALDH1A1LMNAMAPT
SCHEMBL27415577 0.58 KDM4E (0.43) ALDH1A1
SCHEMBL31256887 0.57 PRKCQ (0.42) MCL1
SCHEMBL31256810 0.56 MCL1 (0.33) MCL1
SCHEMBL985114 0.55 ALOX5 (0.46) LMNAMAPT
SCHEMBL4204148 0.55 MTNR1A (0.42) ALDH1A1

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
EP-0563732-A1 7-oxo-7H-pyrido(1,2,3-de)(1,4)benzoxazinecarboxylic acids and esters and their use as antiviral agents BAYER AG (DE) 1993-10-06 EP disclosed