SCHEMBL20195466

SCHEMBL20195466

CCOc1cccc(N(N)C(=O)NN)c1COc1cccc(C)n1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.37
GABRA5 P31644 1/20 0.36
MAPK8 P45983 1/20 0.36
GRM5 P41594 5/20 0.36
TP53 P04637 3/20 0.36
MAPT P10636 5/20 0.35
NPC1 O15118 4/20 0.35
RAB9A P51151 4/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
PKM P14618 2/20 0.35
LMNA P02545 1/20 0.35
GBA1 P04062 1/20 0.34
GRM1 Q13255 2/20 0.34
KDM4E B2RXH2 2/20 0.32
MAPK1 P28482 2/20 0.32
KMT2A Q03164 2/20 0.32
HSD17B10 Q99714 2/20 0.32
ALDH1A1 P00352 2/20 0.32
MEN1 O00255 1/20 0.32
TDP1 Q9NUW8 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
SCHEMBL20195661 0.82 RXRA (0.39) P2RX7GABRA5GRM5GRM1
SCHEMBL20195662 0.82 P2RX7 (0.40) P2RX7GRM5TP53MAPTNPC1
SCHEMBL20195548 0.82 P2RX7 (0.36) P2RX7GABRA5GRM5GRM1
SCHEMBL22038669 0.79 HTR7 (0.38) MAPTNPC1RAB9ASMN1; SMN2LMNA
SCHEMBL22563891 0.79 NR1H4 (0.37) MAPTSMN1; SMN2LMNAKDM4EHSD17B10
SCHEMBL18831735 0.77 GLA (0.39) MAPTLMNAKMT2AHSD17B10ALDH1A1
SCHEMBL20195510 0.77 MAPK8 (0.33) MAPK8GRM5GRM1
SCHEMBL22037222 0.77 ALDH1A1 (0.40) TP53MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL22564003 0.77 ALDH1A1 (0.39) MAPTNPC1RAB9ASMN1; SMN2PKM
SCHEMBL22564358 0.76 NPSR1 (0.34) TP53MAPTNPC1RAB9ASMN1; SMN2

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