SCHEMBL8634849

SCHEMBL8634849

NS(=O)(=O)c1ccccc1-c1n[nH]c(C(F)(F)F)c1-c1cccc(Cl)c1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 2/20 0.48
MAPT P10636 4/20 0.48
CNR1 P21554 2/20 0.48
CNR2 P34972 2/20 0.48
GPR55 Q9Y2T6 2/20 0.48
MEN1 O00255 1/20 0.48
NR2F2 P24468 1/20 0.48
KMT2A Q03164 1/20 0.48
GYS1 P13807 6/20 0.46
ALOX5AP P20292 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.40
PTGS2 P35354 2/20 0.39
PTGS1 P23219 1/20 0.39
F10 P00742 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
IKBKE Q14164 1/20 0.38
ATM Q13315 1/20 0.37

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
SCHEMBL8634944 0.88 LRRK2 (0.49) LRRK2MAPTCNR1CNR2GPR55
SCHEMBL8632688 0.88 GYS1 (0.58) LRRK2MAPTCNR1CNR2GPR55
SCHEMBL8629979 0.87 GYS1 (0.58) LRRK2MAPTCNR1CNR2GPR55
SCHEMBL8631573 0.87 GYS1 (0.60) LRRK2MAPTCNR1CNR2GPR55
SCHEMBL8630890 0.87 LRRK2 (0.48) LRRK2MAPTCNR1CNR2GPR55
SCHEMBL8629098 0.85 ALOX5AP (0.45) LRRK2MAPTCNR1CNR2GPR55
SCHEMBL8628711 0.85 ALOX5AP (0.43) LRRK2MAPTCNR1CNR2GPR55
SCHEMBL8635288 0.83 MAPT (0.42) LRRK2MAPTCNR1CNR2GPR55
SCHEMBL8634599 0.83 LRRK2 (0.46) LRRK2MAPTCNR1CNR2GPR55
SCHEMBL7778049 0.82 LRRK2 (0.64) LRRK2MAPTCNR1CNR2GPR55

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
US-5756530-A NON-STEROIDAL ANTIINFLAMMATORY AGENTS WITH REDUCED SIDE EFFECTS G. D. SEARLE & CO. (US) 1998-05-26 US disclosed