SCHEMBL16720201

SCHEMBL16720201

Oc1ccc[c]c1-c1ccc(Cl)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.45
CYP1A2 P05177 1/20 0.38
NPC1 O15118 4/20 0.35
RAB9A P51151 4/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
AR P10275 1/20 0.35
ALDH1A1 P00352 4/20 0.35
LMNA P02545 2/20 0.35
KDM4E B2RXH2 2/20 0.35
ALOX15 P16050 2/20 0.35
CYP3A4 P08684 2/20 0.35
HSD17B10 Q99714 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
CA12 O43570 1/20 0.35
GMNN O75496 1/20 0.35
EGFR P00533 1/20 0.35
CA2 P00918 1/20 0.35
FYN P06241 1/20 0.35
POLB P06746 1/20 0.35

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
SCHEMBL9987990 0.83 ESR1 (0.42) ALOX5NPC1RAB9AMEN1KMT2A
SCHEMBL6607387 0.81 ALDH1A1 (0.46) ALOX5NPC1RAB9AMEN1KMT2A
SCHEMBL9988099 0.80 TRPA1 (0.37) CYP1A2NPC1RAB9AMEN1KMT2A
SCHEMBL9650164 0.80 NPC1 (0.35) ALOX5NPC1RAB9AMEN1KMT2A
SCHEMBL16719770 0.79 ESR2 (0.52) ALOX5ARALDH1A1HSD17B10CA2
SCHEMBL16719910 0.79 ALOX5 (0.55) ALOX5NPC1RAB9AALOX15EGFR
SCHEMBL435757 0.79 CYP1A2 (0.41) ALOX5CYP1A2NPC1RAB9AALDH1A1
SCHEMBL16720189 0.78 ALOX5 (0.37) ALOX5NPC1RAB9AALDH1A1LMNA
SCHEMBL4653269 0.78 CYP1A2 (0.39) ALOX5CYP1A2NPC1RAB9AALDH1A1
SCHEMBL16720369 0.77 MKNK1 (0.37) ALOX5NPC1RAB9AALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3068758-A1 EBNA1 INHIBITORS AND THEIR METHOD OF USE The Wistar Institute Of Anatomy And Biology (US) 2016-09-21 EP disclosed
WO-2015073864-A1 EBNA1 INHIBITORS AND THEIR METHOD OF USE THE WISAR INSTITUTE OF ANATOMY AND BIOLOGY (US) 2015-05-21 WO disclosed