SCHEMBL9522926

SCHEMBL9522926

C#CCOC(=O)c1cc(-n2c(=O)cc(C)n(C(F)F)c2=O)c(F)cc1Cl

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FNTA P49354 4/20 0.38
FNTB P49356 4/20 0.38
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPC1 O15118 1/20 0.34
BAZ2B Q9UIF8 1/20 0.34
BAZ2A Q9UIF9 1/20 0.34
ATM Q13315 1/20 0.33
GAA P10253 2/20 0.33
CYP1A2 P05177 1/20 0.32
CYP2C19 P33261 1/20 0.32
GUSB P08236 1/20 0.32
CMA1 P23946 1/20 0.31

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
SCHEMBL9523542 0.86 MAPT (0.35) LMNAMAPTHPGDSMN1; SMN2GAA
SCHEMBL9521572 0.84 LMNA (0.34) LMNAMAPTHPGDSMN1; SMN2
SCHEMBL9494830 0.82 NOTUM (0.38) HPGDSMN1; SMN2
SCHEMBL9497433 0.81 CA12 (0.39) LMNAMAPTHPGDSMN1; SMN2NPC1
SCHEMBL9796159 0.81 BAZ2B (0.34) LMNAMAPTHPGDSMN1; SMN2BAZ2B
SCHEMBL9796398 0.80 LMNA (0.34) LMNAMAPTHPGDSMN1; SMN2BAZ2B
SCHEMBL9495959 0.80 HPGD (0.32) LMNAMAPTHPGDSMN1; SMN2NPC1
SCHEMBL9877333 0.76 HPGD (0.44) LMNAMAPTHPGDNPC1ATM
SCHEMBL9519617 0.73 LMNA (0.34) LMNAMAPTHPGDSMN1; SMN2BAZ2B
SCHEMBL9468816 0.73 NPC1 (0.37) FNTAFNTBLMNAMAPTNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0323487-B1 HETEROCYCLIC COMPOUNDS CIBA-GEIGY AG (CH) 1993-03-31 EP claimed
US-4941909-A HERBICIDES, PYRIMIDONE BENZOATES HOFFMANN-LA ROCHE INC. (US) 1990-07-17 US disclosed