SCHEMBL14724945

SCHEMBL14724945

OCc1ccccc1OCl

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
APOBEC3G Q9HC16 1/20 0.43
KDM4E B2RXH2 1/20 0.41
MAPK1 P28482 1/20 0.41
EPHX1 P07099 1/20 0.40
SLC6A2 P23975 2/20 0.37
SLC6A4 P31645 2/20 0.37
PDCD1 Q15116 1/20 0.36
CD274 Q9NZQ7 1/20 0.36
CYP4F2 P78329 1/20 0.35
CYP4A11 Q02928 1/20 0.35
CXCL8 P10145 1/20 0.35
TSHR P16473 1/20 0.35
IDO1 P14902 2/20 0.34
CYP2A6 P11509 1/20 0.34
ALDH1A1 P00352 1/20 0.33
TP53 P04637 1/20 0.33
HTT P42858 1/20 0.33
TAAR1 Q96RJ0 1/20 0.33

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
SCHEMBL5950358 0.80 SLC6A2 (0.50) APOBEC3GKDM4EMAPK1EPHX1SLC6A2
SCHEMBL27946664 0.76 KDM4E (0.57) APOBEC3GKDM4EMAPK1IDO1ALDH1A1
SCHEMBL467713 0.76 KDM4E (0.45) APOBEC3GKDM4EMAPK1EPHX1SLC6A2
SCHEMBL17820 0.76 IDO1 (0.57) TSHRIDO1ALDH1A1TP53TAAR1
SCHEMBL30829273 0.76 IDO1 (0.57) TSHRIDO1ALDH1A1TP53TAAR1
SCHEMBL6278011 0.76 APOBEC3G (0.43) APOBEC3GKDM4EMAPK1EPHX1SLC6A2
SCHEMBL11001855 0.76 APOBEC3G (0.43) APOBEC3GKDM4EMAPK1EPHX1SLC6A2
SCHEMBL30065199 0.76 APOBEC3G (0.43) APOBEC3GKDM4EMAPK1EPHX1SLC6A2
SCHEMBL8053490 0.76 RIPK1 (0.39) APOBEC3GKDM4EMAPK1EPHX1SLC6A2
SCHEMBL17445915 0.74 KDM4E (0.51) KDM4EMAPK1TSHRTP53

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-2562175-A1 5-FLUORO PYRIMIDINE DERIVATIVES AS FUNGICIDES Dow AgroSciences LLC (US) 2013-02-27 EP disclosed