SCHEMBL16609264

SCHEMBL16609264

Cc1cccc(-n2nnn(C)c2=O)c1COc1ccc2cc(-c3ccc(Cl)cc3)ccc2c1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 6/20 0.39
SLC6A9 P48067 1/20 0.37
KCNH2 Q12809 1/20 0.37
KDM4E B2RXH2 2/20 0.36
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
PTGER4 P35408 1/20 0.36
POLB P06746 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL16206147 0.92 SLC22A12 (0.40) NR1H4MEN1MAPTKMT2APTGER4
SCHEMBL17614583 0.89 GYS1 (0.36) SLC6A9KCNH2POLBRXFP1MAOA
SCHEMBL16206003 0.88 CHRNB1 (0.41)
SCHEMBL17614597 0.87 GYS1 (0.37) SLC6A9KCNH2MAPT
SCHEMBL16205936 0.86 GRM5 (0.38) KDM4EMEN1MAPTKMT2APTGER4
SCHEMBL17806061 0.86 MRGPRX4 (0.39) NR1H4KDM4EMEN1MAPTKMT2A
SCHEMBL17614539 0.86 SLC22A12 (0.37) MAPTL3MBTL1
SCHEMBL16206157 0.86 AIMP2 (0.33) SLC6A9KCNH2MEN1KMT2APOLB
SCHEMBL16206008 0.85 SMN1; SMN2 (0.35) MAPTL3MBTL1
SCHEMBL16205980 0.85 ALOX5AP (0.36) MAPTPOLBRXFP1TSHR

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
WO-2015046480-A1 TETRAZOLINONE COMPOUND AND USE THEREOF 住友化学株式会社 2015-04-02 WO disclosed