SCHEMBL19987601

SCHEMBL19987601

CN(N)C(=O)N(N)c1ccccc1COc1cc(Cl)c(O)cc1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 6/20 0.44
HTT P42858 2/20 0.39
TP53 P04637 1/20 0.39
HDAC8 Q9BY41 2/20 0.37
HSP90AA1 P07900 1/20 0.37
MCL1 Q07820 1/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.36
TRPM8 Q7Z2W7 2/20 0.36
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
MAOA P21397 1/20 0.35
FFAR1 O14842 1/20 0.35
FFAR4 Q5NUL3 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
NPC1 O15118 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL18831547 0.85 MAOA (0.37) MRGPRX4HTTMAOANPC1ALDH1A1
SCHEMBL18831746 0.84 SLC22A12 (0.37) MRGPRX4HTTHSP90AA1MAOANPC1
SCHEMBL18831506 0.83 LMNA (0.34) MRGPRX4HTTMAOANPC1ALDH1A1
SCHEMBL18831587 0.80 MRGPRX4 (0.37) MRGPRX4MAOA
SCHEMBL23506126 0.76 SMN1; SMN2 (0.47) MAOAFFAR1NPC1ALDH1A1MAPT
SCHEMBL18831522 0.76 ALPL (0.36) MRGPRX4HSP90AA1
SCHEMBL23506206 0.75 FFAR4 (0.42) PTGDR2FFAR1FFAR4ALDH1A1MAPT
SCHEMBL20686643 0.75 MRGPRX4 (0.41) MRGPRX4HTTNPC1ALDH1A1MAPT
SCHEMBL18831366 0.75 SLC22A12 (0.33) MRGPRX4HSP90AA1FFAR4SMN1; SMN2
SCHEMBL18831656 0.75 GRM5 (0.38) MRGPRX4TP53ALDH1A1MAPTRAB9A

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-3006440-B1 TETRAZOLINONE COMPOUND AND APPLICATION OF SAME SUMITOMO CHEMICAL CO (JP) 2018-03-21 EP disclosed