SCHEMBL3237157

SCHEMBL3237157

O=C(O)Oc1cn(Cc2ccc(F)cc2)c2cc(Cl)c(F)cc2c1=O

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.48
PRNP P04156 1/20 0.47
TP53 P04637 2/20 0.47
RXFP1 Q9HBX9 2/20 0.45
THRB P10828 2/20 0.45
POLB P06746 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
GAA P10253 1/20 0.44
TOP1 P11387 2/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL3238815 0.89 PDE4A (0.44) MAPTPRNPTP53TOP1
SCHEMBL3241407 0.88 SERPINE1 (0.46) MAPTTP53THRBTOP1
SCHEMBL3234629 0.85 TP53 (0.50) MAPTPRNPTP53RXFP1THRB
SCHEMBL3237152 0.85 TOP1 (0.57) MAPTPRNPTP53RXFP1TOP1
SCHEMBL3242072 0.84 ICMT (0.50) MAPTTP53RXFP1SMN1; SMN2GAA
SCHEMBL6202850 0.84 HPGD (0.47) MAPTPOLBGAAMEN1KMT2A
SCHEMBL8130462 0.83 LMNA (0.47) MEN1KMT2A
SCHEMBL6214042 0.83 PIM1 (0.42) MAPTPOLBTOP1MEN1KMT2A
SCHEMBL30064588 0.81 PPARD (0.46) MAPTPRNPTP53RXFP1POLB
SCHEMBL3239683 0.79 P2RX3 (0.43) MAPTPRNPTP53RXFP1POLB

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-1963271-B1 QUINOLONE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS MERCK SHARP & DOHME (US) 2010-07-28 EP claimed