SCHEMBL23259192

SCHEMBL23259192

O=c1ccc(Cl)ccc1OCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 3/20 0.50
NPSR1 Q6W5P4 1/20 0.49
MAPK14 Q16539 1/20 0.49
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
ATM Q13315 1/20 0.48
SLC6A4 P31645 1/20 0.48
CCR5 P51681 1/20 0.47
JAK2 O60674 1/20 0.46
ZAP70 P43403 1/20 0.46
PPIA P62937 1/20 0.46
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
MAPT P10636 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
MAPK1 P28482 1/20 0.46
TDP1 Q9NUW8 1/20 0.46

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
SCHEMBL23258867 0.83 MAPT (0.59) PTGER1MAPK14MAPTL3MBTL1MAPK1
SCHEMBL23258790 0.82 APP (0.55) MAPK14SMN1; SMN2MAPTL3MBTL1MAPK1
SCHEMBL11147828 0.82 MAOB (0.59) MAPK14SMN1; SMN2MAPTL3MBTL1MAPK1
SCHEMBL23258693 0.82 L3MBTL1 (0.51) PTGER1MAPK14KMT2AALDH1A1LMNA
SCHEMBL23258431 0.82 RAB9A (0.49) MAPK14SLC6A4CCR5ALDH1A1HTT
SCHEMBL23258799 0.82 MAPT (0.55) PTGER1MAPK14ALDH1A1LMNAHTT
SCHEMBL23259194 0.76 PTGER1 (0.51) PTGER1MAPK14SLC6A4JAK2ZAP70
SCHEMBL23259193 0.76 MRGPRX4 (0.58) PTGER1SLC6A4JAK2ZAP70MAPT
SCHEMBL23258555 0.76 MAOB (0.49) MEN1KMT2AATMKDM4ESMN1; SMN2
SCHEMBL23263868 0.76 L3MBTL1 (0.46) MAPK14MEN1KMT2AALDH1A1LMNA

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
WO-2021076938-A1 TROPOLONE DERIVATIVES AND TAUTOMERS THEREOF FOR IRON REGULATION IN ANIMALS Ambys Medicines, Inc. (US) 2021-04-22 WO disclosed