SCHEMBL22563853

SCHEMBL22563853

COc1cccc(C(=O)O)c1COc1ccn(S)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.39
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA7 P43166 1/20 0.37
CA9 Q16790 1/20 0.37
CA14 Q9ULX7 1/20 0.37
APEX1 P27695 1/20 0.37
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
PDE4D Q08499 1/20 0.36
FABP4 P15090 2/20 0.36
NR1H4 Q96RI1 1/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
HSD17B10 Q99714 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 1/20 0.36
HPGD P15428 1/20 0.36
MRGPRX4 Q96LA9 1/20 0.36

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
SCHEMBL22564534 0.89 LMNA (0.39) HTTNPC1RAB9ASMN1; SMN2LMNA
SCHEMBL22564307 0.89 NPC1 (0.36) HTTNPC1RAB9ASMN1; SMN2LMNA
SCHEMBL22563971 0.89 MAPT (0.40) HTTNPC1RAB9AKDM4EALDH1A1
SCHEMBL22564474 0.89 HTT (0.40) HTTAPEX1NPC1RAB9ANR1H4
SCHEMBL22564338 0.89 CTSD (0.35) HTTNPC1RAB9ANR1H4SMN1; SMN2
SCHEMBL22564283 0.87 NR1H4 (0.38) APEX1NR1H4KDM4EALDH1A1LMNA
SCHEMBL22564542 0.87 NPC1 (0.37) HTTNPC1RAB9ASMN1; SMN2LMNA
SCHEMBL22564309 0.87 NPC1 (0.37) NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL22564009 0.87 APEX1 (0.34) HTTAPEX1NPC1FABP4NR1H4
SCHEMBL18504650 0.87 HTT (0.40) HTTCA12CA1CA2CA7

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