SCHEMBL5740464

SCHEMBL5740464

Cc1ccc(F)c(-n2nnc(CCO)n2)c1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RXRA P19793 3/20 0.38
GRIN1 Q05586 3/20 0.38
GRIN2B Q13224 3/20 0.38
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
RAB9A P51151 1/20 0.33
FFAR4 Q5NUL3 1/20 0.32
KDM4E B2RXH2 2/20 0.31
DHODH Q02127 2/20 0.31
NOTUM Q6P988 1/20 0.31
KMT2A Q03164 1/20 0.30

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
SCHEMBL2895280 0.90 RXRA (0.40) RXRAGRIN1GRIN2BNPC1LMNA
SCHEMBL5739224 0.84 NOTUM (0.37) KDM4ENOTUM
SCHEMBL2892992 0.76 RXRA (0.39) RXRAGRIN1GRIN2BLMNA
SCHEMBL2488620 0.74 TLR8 (0.43) RXRAGRIN1GRIN2BLMNAKMT2A
SCHEMBL27669088 0.74 KIF11 (0.39) GRIN2BLMNAFFAR4KDM4EKMT2A
SCHEMBL2889384 0.73 RXRA (0.36) RXRAGRIN1GRIN2BNPC1LMNA
SCHEMBL5741042 0.72 MAPT (0.51) NPC1LMNARAB9AKDM4EKMT2A
SCHEMBL2895031 0.71 RXRA (0.39) RXRAGRIN1GRIN2BNPC1LMNA
SCHEMBL2893736 0.71 ALDH1A1 (0.50) LMNAKDM4E
SCHEMBL5740390 0.71 LMNA (0.34) RXRAGRIN1GRIN2BNPC1LMNA

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-1716125-A1 TETRAZOLE COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR ANTAGONITS AstraZeneca AB (SE) 2006-11-02 EP disclosed
WO-2005080356-A1 TETRAZOLE COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR ANTAGONITS ASTRAZENECA AB (SE) 2005-09-01 WO disclosed