SCHEMBL22563773

SCHEMBL22563773

Cc1cccc(N(N)C(=O)NN)c1COc1ccn(-c2ccccc2F)n1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KLKB1 P03952 1/20 0.32
CACNA2D1 P54289 1/20 0.32
POLB P06746 1/20 0.32
NPY5R Q15761 4/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CYP3A4 P08684 1/20 0.31
CTSA P10619 1/20 0.31
PTGER1 P34995 1/20 0.31
PDE2A O00408 1/20 0.31
GUCY1B2 O75343 2/20 0.31
GUCY1A2 P33402 2/20 0.31
GUCY1A1 Q02108 2/20 0.31
GUCY1B1 Q02153 2/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
ADORA1 P30542 1/20 0.30

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
SCHEMBL22563772 0.92 KDM4E (0.34) CACNA2D1KDM4EALDH1A1MAPT
SCHEMBL22563775 0.89 ALDH1A1 (0.31) SMN1; SMN2KDM4EALDH1A1MAPT
SCHEMBL22564161 0.89 NR1H4 (0.37) SMN1; SMN2CYP3A4PDE2AKDM4EALDH1A1
SCHEMBL22564364 0.88 KMT2A (0.34) SMN1; SMN2KDM4EALDH1A1MAPT
SCHEMBL22564091 0.88 NR1H4 (0.38) CACNA2D1POLBKDM4EALDH1A1MAPT
SCHEMBL22564153 0.87 ALDH1A1 (0.33) SMN1; SMN2ALDH1A1MAPT
SCHEMBL20902038 0.86 NR1H4 (0.35) CYP3A4PTGER1
SCHEMBL22563841 0.85 NR1H4 (0.37) CACNA2D1POLBKDM4EALDH1A1
SCHEMBL20844961 0.85 P2RX7 (0.32) KDM4EALDH1A1MAPT
SCHEMBL20902007 0.83 ALDH1A1 (0.41) POLBCYP3A4KDM4EALDH1A1MAPT

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