SCHEMBL22564091

SCHEMBL22564091

Cc1cccc(N(N)C(=O)NN)c1COc1ccn(-c2ccccc2)n1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 1/20 0.38
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 2/20 0.36
GAA P10253 2/20 0.35
MAPT P10636 3/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
TSHR P16473 1/20 0.35
HTT P42858 1/20 0.35
HSD17B10 Q99714 1/20 0.35
POLB P06746 1/20 0.34
P2RX7 Q99572 1/20 0.33
CACNA1G O43497 1/20 0.33
CACNA1H O95180 1/20 0.33
CACNA1I Q9P0X4 1/20 0.33
ELOVL1 Q9BW60 6/20 0.33
CACNA2D1 P54289 1/20 0.32
FFAR1 O14842 1/20 0.32
KMT2A Q03164 1/20 0.32
CYP2C9 P11712 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
SCHEMBL20902007 0.92 ALDH1A1 (0.41) NR1H4ALDH1A1KDM4EGAAMAPT
SCHEMBL19909882 0.92 NR1H4 (0.33) NR1H4ALDH1A1HTT
SCHEMBL22563772 0.91 KDM4E (0.34) NR1H4ALDH1A1KDM4EMAPTCACNA2D1
SCHEMBL22563841 0.90 NR1H4 (0.37) NR1H4ALDH1A1KDM4ETSHRPOLB
SCHEMBL22564351 0.90 ALDH1A1 (0.36) NR1H4ALDH1A1MAPTHSD17B10CACNA2D1
SCHEMBL22564154 0.90 NR1H4 (0.37) NR1H4ALDH1A1FFAR1KMT2A
SCHEMBL22563918 0.89 SIGMAR1 (0.40) NR1H4KDM4EMAPTPOLBKMT2A
SCHEMBL22563758 0.89 UBE2N (0.35) NR1H4ALDH1A1MAPTL3MBTL1
SCHEMBL22563773 0.88 KLKB1 (0.32) ALDH1A1KDM4EMAPTPOLBCACNA2D1
SCHEMBL22564161 0.88 NR1H4 (0.37) NR1H4ALDH1A1KDM4EMAPTP2RX7

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-2841429-B1 TETRAZOLINONE COMPOUNDS AND ITS USE AS PESTICIDES SUMITOMO CHEMICAL CO (JP) 2020-10-21 EP disclosed