SCHEMBL9150832

SCHEMBL9150832

O=C(O)c1c(O)ncc(F)c1O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.41
ASPH Q12797 2/20 0.41
KDM8 Q8N371 2/20 0.41
ALB P02768 1/20 0.35
DPP4 P27487 2/20 0.33
GSK3A P49840 1/20 0.33
GSK3B P49841 1/20 0.33
CA12 O43570 2/20 0.32
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
CA7 P43166 2/20 0.32
CA9 Q16790 2/20 0.32
CA14 Q9ULX7 2/20 0.32
LMNA P02545 2/20 0.32
HSD17B10 Q99714 2/20 0.32
ALDH1A1 P00352 2/20 0.32
TP53 P04637 1/20 0.32
CA3 P07451 1/20 0.32
MAPT P10636 1/20 0.32
SELL P14151 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
SCHEMBL27531532 0.82 CYP3A4 (0.34) KDM4EASPHKDM8HPGDKMT2A
SCHEMBL31574400 0.75 DPP4 (0.52) KDM4EDPP4HSD17B10ALDH1A1MAPK1
SCHEMBL10760359 0.73 DPP4 (0.41) KDM4EASPHKDM8DPP4HSD17B10
SCHEMBL10765922 0.71 KDM4E (0.46) KDM4EASPHKDM8ALBDPP4
SCHEMBL21262024 0.69 ALB (0.50) KDM4EALBDPP4CA12CA1
SCHEMBL3520296 0.68 EGLN3 (0.37) KDM4EASPHKDM8ALBDPP4
SCHEMBL3105391 0.68 KDM4E (0.42) KDM4EASPHKDM8GSK3AGSK3B
SCHEMBL10465944 0.68 KDM4E (0.42) KDM4EASPHKDM8GSK3AGSK3B
Hydrochloric Acid SCHEMBL9651745 0.67 KDM4E (0.41) KDM4EASPHKDM8CA1CA2
SCHEMBL10766033 0.67 DPP4 (0.42) KDM4EDPP4CA12CA1CA2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0655998-A1 IMPROVED PROCESS FOR THE SYNTHESIS OF 2,6-DICHLORO-5-FLUORONICOTINIC ACID AND 2,6-DICHLORO-5-FLUORONICOTINOYL CHLORIDE. WARNER LAMBERT CO (US) 1995-06-07 EP claimed
WO-1994004501-A1 IMPROVED PROCESS FOR THE SYNTHESIS OF 2,6-DICHLORO-5-FLUORONICOTINIC ACID AND 2,6-DICHLORO-5-FLUORONICOTINOYL CHLORIDE WARNER-LAMBERT COMPANY (US) 1994-03-03 WO claimed
EP-0655998-A1 IMPROVED PROCESS FOR THE SYNTHESIS OF 2,6-DICHLORO-5-FLUORONICOTINIC ACID AND 2,6-DICHLORO-5-FLUORONICOTINOYL CHLORIDE. WARNER LAMBERT CO (US) 1995-06-07 EP disclosed
WO-1994004501-A1 IMPROVED PROCESS FOR THE SYNTHESIS OF 2,6-DICHLORO-5-FLUORONICOTINIC ACID AND 2,6-DICHLORO-5-FLUORONICOTINOYL CHLORIDE WARNER-LAMBERT COMPANY (US) 1994-03-03 WO disclosed