SCHEMBL10524729

SCHEMBL10524729

CC(=O)Oc1ccc(OC(C)=O)c2c(CC(O)C(O)Cl)cccc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38
KDM4E B2RXH2 3/20 0.37
CYP3A4 P08684 1/20 0.37
ALOX12 P18054 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
TYMS P04818 1/20 0.36
SLC22A6 Q4U2R8 1/20 0.35
AKT1 P31749 1/20 0.35
BRD4 O60885 1/20 0.35
HTT P42858 2/20 0.35
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
LMNA P02545 1/20 0.34
PKM P14618 1/20 0.34
HSD17B10 Q99714 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
MAPK1 P28482 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
Hydrochloric Acid SCHEMBL11269182 0.76 SOS2 (0.39) PPARGPPARAKDM4ENPC1RAB9A
SCHEMBL10524862 0.74 CFD (0.41) KDM4EAKT1HTTRAB9AHSD17B10
SCHEMBL3174222 0.71 MAPT (0.55) KDM4ECYP3A4ALOX12TDP1SLC22A6
Hydrochloric Acid SCHEMBL11272178 0.69 CDYL (0.40) PPARGPPARAKDM4ETDP1TYMS
SCHEMBL18499932 0.69 ALDH1A1 (0.58) KDM4ECYP3A4SLC22A6HTTNPC1
SCHEMBL30002719 0.68 HTT (0.61) KDM4ECYP3A4ALOX12TDP1SLC22A6
SCHEMBL6688920 0.68 HTT (0.56) KDM4ECYP3A4ALOX12TDP1SLC22A6
SCHEMBL4444465 0.68 HTT (0.61) KDM4ECYP3A4ALOX12TDP1SLC22A6
SCHEMBL926733 0.67 SLC22A6 (0.42) KDM4ECYP3A4ALOX12TDP1TYMS
SCHEMBL7638665 0.67 KDM4E (0.46) KDM4ECYP3A4ALOX12TDP1TYMS

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
US-4840965-A LIPOXYGENASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1989-06-20 US disclosed