SCHEMBL15851069

SCHEMBL15851069

COc1cccc(-n2nnn(C)c2=O)c1COc1ccc(O)cc1C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATP4A P20648 2/20 0.40
ATP4B P51164 2/20 0.40
IL6 P05231 1/20 0.37
POLH Q9Y253 1/20 0.35
MRGPRX4 Q96LA9 5/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
EPHB4 P54760 1/20 0.34
HTR1A P08908 1/20 0.33
DRD2 P14416 1/20 0.33
HTR2A P28223 1/20 0.33
HTR7 P34969 1/20 0.33
ADRA1A P35348 1/20 0.33
APLNR P35414 1/20 0.33
HTT P42858 1/20 0.33
CA2 P00918 1/20 0.33
CA5A P35218 1/20 0.33
CA9 Q16790 1/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32

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
SCHEMBL19646234 0.92 ATP4A (0.36) ATP4AATP4BMRGPRX4MEN1KMT2A
SCHEMBL16920776 0.91 HTR1A (0.42) MRGPRX4MEN1KMT2AHTR1ADRD2
SCHEMBL15851198 0.90 SLC22A12 (0.36) ATP4AATP4BIL6MRGPRX4
SCHEMBL16442886 0.89 HTT (0.44) MRGPRX4MEN1KMT2AHTT
SCHEMBL15851207 0.89 IL6 (0.37) IL6MRGPRX4MEN1KMT2AHTT
SCHEMBL16385570 0.89 MAPT (0.39) MEN1KMT2ANPC1RAB9A
SCHEMBL19646109 0.89 ATP4A (0.34) ATP4AATP4BIL6MRGPRX4APLNR
SCHEMBL15851208 0.89 MRGPRX4 (0.37) IL6MRGPRX4CA2CA5ACA9
SCHEMBL15851090 0.89 LMNA (0.35) ATP4AATP4BIL6MRGPRX4MEN1
SCHEMBL15851196 0.89 ATP4A (0.38) ATP4AATP4BIL6MRGPRX4MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9828389-B2 Tetrazolinone compounds and their use as pesticides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-11-28 US disclosed
US-9560850-B2 Tetrazolinone compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-02-07 US disclosed
EP-2940012-A1 TETRAZOLINONE COMPOUND AND APPLICATIONS THEREOF Sumitomo Chemical Company Limited (JP) 2015-11-04 EP disclosed
WO-2014104384-A1 TETRAZOLINONE COMPOUND AND APPLICATIONS THEREOF 住友化学株式会社 (JP) 2014-07-03 WO disclosed