SCHEMBL20195470

SCHEMBL20195470

Cc1cccnc1OCc1c(OC(F)F)cccc1N(N)C(=O)NN

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SGMS2 Q8NHU3 1/20 0.33
HTT P42858 3/20 0.33
NPSR1 Q6W5P4 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
KMT2A Q03164 1/20 0.33
ALDH1A1 P00352 3/20 0.33
DRD1 P21728 3/20 0.33
MAPT P10636 3/20 0.32
TRPV4 Q9HBA0 1/20 0.32
LMNA P02545 2/20 0.32
KDM4E B2RXH2 1/20 0.32
P2RX7 Q99572 1/20 0.32
RXRA P19793 1/20 0.31
GRIN1 Q05586 1/20 0.31
GRIN2B Q13224 1/20 0.31
ATM Q13315 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL20195625 0.77 NPC1 (0.38) SGMS2HTTL3MBTL1KMT2AALDH1A1
SCHEMBL20195662 0.75 P2RX7 (0.40) SGMS2HTTKMT2AALDH1A1MAPT
SCHEMBL20195555 0.73 HTR2C (0.39) SGMS2ALDH1A1MAPTKDM4EP2RX7
SCHEMBL23506201 0.72 SCN9A (0.36) SGMS2ALDH1A1MAPTKDM4E
SCHEMBL23506123 0.72 SYK (0.36) SGMS2HTTL3MBTL1KMT2AALDH1A1
SCHEMBL20844961 0.72 P2RX7 (0.32) ALDH1A1MAPTKDM4EP2RX7
SCHEMBL20195533 0.71 P2RX7 (0.38) SGMS2L3MBTL1KMT2AALDH1A1MAPT
SCHEMBL22059937 0.71 MRGPRX4 (0.46) L3MBTL1KMT2AALDH1A1MAPTLMNA
SCHEMBL22563824 0.71 SMN1; SMN2 (0.37) HTTL3MBTL1KMT2AALDH1A1MAPT
SCHEMBL20195467 0.71 FFAR1 (0.42) SGMS2ALDH1A1MAPTKDM4EGRIN2B

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-3029035-B1 TETRAZOLINONE COMPOUND, AND USE THEREOF SUMITOMO CHEMICAL CO (JP) 2018-05-30 EP disclosed