SCHEMBL3242072

SCHEMBL3242072

O=C(O)Oc1cn(Cc2cccc(C(F)(F)F)c2)c2cc(Cl)c(F)cc2c1=O

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ICMT O60725 8/20 0.50
MAPT P10636 2/20 0.42
LMNA P02545 1/20 0.42
TP53 P04637 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
P2RX7 Q99572 1/20 0.42
GAA P10253 1/20 0.41
S1PR1 P21453 2/20 0.41
S1PR5 Q9H228 2/20 0.41
ATM Q13315 1/20 0.40
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 1/20 0.39
SMN1; SMN2 Q16637 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
SCHEMBL3238815 0.90 PDE4A (0.44) ICMTMAPTTP53P2RX7KDM4E
SCHEMBL3236944 0.87 ICMT (0.52) ICMTLMNAATM
SCHEMBL3238079 0.87 ICMT (0.45) ICMTMAPTLMNATP53RXFP1
SCHEMBL3237157 0.84 MAPT (0.48) MAPTTP53RXFP1GAASMN1; SMN2
SCHEMBL3241407 0.83 SERPINE1 (0.46) MAPTLMNATP53P2RX7ALDH1A1
SCHEMBL3234280 0.82 CHRM1 (0.49) ICMTMAPTLMNATP53RXFP1
SCHEMBL6202850 0.79 HPGD (0.47) MAPTLMNAGAAALDH1A1KDM4E
SCHEMBL3242155 0.79 CHRM1 (0.45) ICMTMAPTLMNATP53RXFP1
SCHEMBL3237953 0.77 TOP1 (0.53) LMNA
SCHEMBL6214042 0.76 PIM1 (0.42) MAPTLMNAALDH1A1KDM4E

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