SCHEMBL6767437

SCHEMBL6767437

O=C1COC(c2ccccn2)=NN1c1ccc(F)cc1F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.36
AGTR1 P30556 1/20 0.35
APOBEC3G Q9HC16 1/20 0.35
MAPT P10636 2/20 0.35
GAA P10253 2/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
FFAR1 O14842 1/20 0.34
RAB9A P51151 2/20 0.34
CTSD P07339 1/20 0.34
GUSB P08236 1/20 0.34
POLB P06746 1/20 0.34
PDE4B Q07343 1/20 0.34
SLC5A1 P13866 1/20 0.34
SLC5A2 P31639 1/20 0.34
KMT2A Q03164 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
GLA P06280 1/20 0.33
METAP2 P50579 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
Hydrochloric Acid SCHEMBL6765921 0.99 MAPK14 (0.35) MAPK14AGTR1APOBEC3GMAPTGAA
SCHEMBL5778171 0.88 MEN1 (0.39) MAPTKDM4EALDH1A1HPGDRAB9A
SCHEMBL6766363 0.79 CYP2D6 (0.47) MAPK14GAAALDH1A1KMT2AGLA
SCHEMBL5780049 0.78 SLC5A2 (0.36) MAPTKDM4EALDH1A1RAB9APOLB
SCHEMBL6763399 0.78 HTR7 (0.35) MAPTGAAKDM4EALDH1A1POLB
SCHEMBL6763497 0.78 PDCD1 (0.42) GAAKDM4ERAB9APOLBKMT2A
SCHEMBL5778501 0.77 MAPT (0.42) MAPTGAAKDM4EALDH1A1RAB9A
Hydrochloric Acid SCHEMBL5780693 0.76 MAPT (0.41) MAPTGAAKDM4EALDH1A1RAB9A
SCHEMBL6767423 0.75 GRIA1 (0.37) KDM4EFFAR1SLC5A1SLC5A2KMT2A
SCHEMBL6768404 0.71 MAPK14 (0.51) MAPK14KDM4EPOLBL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1153922-A1 HETERODIAZINONE DERIVATIVES Eisai Co., Ltd. (JP) 2001-11-14 EP claimed
US-6825192-B1 NON-N-METHYL-D-ASPARTATE (NON- NMDA) EXCITATORY AMINO ACID RECEPTOR ANTAGONISTIC ACTION, FOR EXAMPLE 2-AMINO-3-HYDROXY-5-METHYL-4-ISOXAZOLE PROPIONIC ACID (AMPA) RECEPTOR ANTAGONISTIC ACTION EISAI CO., LTD. (JP) 2004-11-30 US disclosed
EP-1153922-A1 HETERODIAZINONE DERIVATIVES Eisai Co., Ltd. (JP) 2001-11-14 EP disclosed