SCHEMBL6763441

SCHEMBL6763441

CN(CCOc1ccccc1C1=NN(c2ccccc2Br)C(=O)CO1)Cc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.46
MAOB P27338 3/20 0.41
HTR1D P28221 1/20 0.41
HTR1B P28222 1/20 0.41
GAA P10253 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
IKBKB O14920 1/20 0.38
HTR6 P50406 1/20 0.37
KDM4E B2RXH2 1/20 0.37
NPY1R P25929 1/20 0.37
NPY2R P49146 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
TSHR P16473 1/20 0.36
BCHE P06276 1/20 0.36
ACHE P22303 1/20 0.36

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
SCHEMBL5781166 0.89 HTR7 (0.46) MAOBHTR1BSMN1; SMN2KDM4EBCHE
Hydrochloric Acid SCHEMBL5782879 0.88 HTR7 (0.45) MAOBHTR1BSMN1; SMN2KDM4EBCHE
SCHEMBL6772719 0.81 KDM4E (0.41) LMNAHTR1DHTR1BGAASMN1; SMN2
SCHEMBL6766055 0.78 CASP6 (0.41) LMNAMAOBGAAKDM4EL3MBTL1
SCHEMBL5780812 0.78 HTR7 (0.42) MAOBHTR1BSMN1; SMN2KDM4EBCHE
SCHEMBL5777171 0.77 POLB (0.52) MAOBSMN1; SMN2KDM4EL3MBTL1
SCHEMBL5781445 0.77 HTR7 (0.48) MAOBHTR1BSMN1; SMN2KDM4EBCHE
Hydrochloric Acid SCHEMBL6765889 0.77 HTR7 (0.41) MAOBHTR1BSMN1; SMN2KDM4EBCHE
Hydrochloric Acid SCHEMBL5783222 0.76 POLB (0.51) MAOBSMN1; SMN2KDM4EL3MBTL1
Hydrochloric Acid SCHEMBL5785010 0.76 HTR7 (0.47) MAOBHTR1BSMN1; SMN2KDM4EBCHE

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
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