SCHEMBL6957196

SCHEMBL6957196

CCc1cccc(-c2ccc(OC)cc2)c1C#N

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.47
ALDH1A1 P00352 8/20 0.47
MAPT P10636 7/20 0.47
KDM4E B2RXH2 6/20 0.47
HPGD P15428 5/20 0.47
GAA P10253 3/20 0.47
TDP1 Q9NUW8 2/20 0.47
KMT2A Q03164 5/20 0.47
MEN1 O00255 4/20 0.47
NPC1 O15118 1/20 0.47
CRHBP P24387 1/20 0.47
RAB9A P51151 1/20 0.47
CRHR2 Q13324 1/20 0.47
CD274 Q9NZQ7 2/20 0.46
HTT P42858 2/20 0.46
LDHA P00338 1/20 0.46
GRIA2 P42262 2/20 0.45
GRIA4 P48058 2/20 0.45
NPSR1 Q6W5P4 6/20 0.45
RXFP1 Q9HBX9 3/20 0.45

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
SCHEMBL13675365 0.79 ABL1 (0.56) ALDH1A1MAPTKDM4EHPGDGAA
SCHEMBL7574828 0.78 KMT2A (0.55) GRM2ALDH1A1MAPTKDM4EHPGD
SCHEMBL1679189 0.78 ABL1 (0.41) ALDH1A1MAPTKDM4EHPGDGAA
SCHEMBL13366126 0.78 CD274 (0.47) ALDH1A1MAPTKDM4EHPGDGAA
SCHEMBL13699903 0.78 ABL1 (0.47) MAPTHPGDGAAKMT2AMEN1
SCHEMBL10578467 0.75 KDM4E (0.50) GRM2ALDH1A1MAPTKDM4EHPGD
SCHEMBL11033832 0.75 MAPT (0.46) GRM2ALDH1A1MAPTKDM4EHPGD
SCHEMBL4665425 0.74 ABL1 (0.51) ALDH1A1MAPTKDM4EHPGDTDP1
SCHEMBL9712661 0.74 GABRA1 (0.48) ALDH1A1MAPTKDM4EHPGDGAA
SCHEMBL13365324 0.74 ABL1 (0.44) ALDH1A1MAPTKDM4EHPGDGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0711762-B1 PROCESS FOR PRODUCING TETRAZOLE COMPOUNDS SUMITOMO CHEMICAL CO (JP) 2003-08-06 EP disclosed