SCHEMBL9775929

SCHEMBL9775929

O=c1cc(Cl)c2cc(F)c(F)c(F)c2[nH]1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EIF4A3 P38919 1/20 0.41
GRIN2D O15399 4/20 0.39
GRIN3B O60391 4/20 0.39
GRIN1 Q05586 4/20 0.39
GRIN2A Q12879 4/20 0.39
GRIN2B Q13224 4/20 0.39
GRIN2C Q14957 4/20 0.39
GRIN3A Q8TCU5 4/20 0.39
MAPT P10636 1/20 0.38
NOS2 P35228 10/20 0.36
LMNA P02545 1/20 0.36
KDM4E B2RXH2 1/20 0.35
AR P10275 1/20 0.35
NOS1 P29475 9/20 0.34
NOS3 P29474 8/20 0.34
PDPK1 O15530 1/20 0.33

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
SCHEMBL27164027 0.79 EIF4A3 (0.42) EIF4A3GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL29974598 0.79 EIF4A3 (0.42) EIF4A3GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL4145519 0.71 MAPT (0.33) EIF4A3MAPTNOS2KDM4EAR
SCHEMBL7032887 0.69 GRIN2D (0.38) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL23689986 0.68 DDR1 (0.40) MAPTLMNAKDM4EAR
SCHEMBL25433555 0.67 MAPT (0.38) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL20504757 0.66 EIF4A3 (0.50) EIF4A3MAPT
SCHEMBL20504857 0.66 EIF4A3 (0.50) EIF4A3GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL9267952 0.65 CA12 (0.53) EIF4A3GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL25423146 0.65 MAPT (0.51) MAPTLMNAKDM4EARPDPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5053509-A Microbiocides; AIDS LABORATOIRE ROGER BELLON (FR) 1991-10-01 US disclosed
US-5004745-A Benzo[1,8]naphthyridine derivatives, their preparation and the compositions which contain them LABORATOIRE ROGER BELLON (FR) 1991-04-02 US disclosed
US-4990515-A Chemical intermediates RHONE-POULENC SANTE (FR) 1991-02-05 US disclosed
US-4970213-A Benzo(1,8)naphthyridine derivatives as intermediates RHONE-POULENC SANTE (FR) 1990-11-13 US disclosed