SCHEMBL6506841

SCHEMBL6506841

Nc1ccc(Oc2ccc(Cl)c(Cl)c2)nc1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.75
POLB P06746 2/20 0.75
MEN1 O00255 4/20 0.58
KMT2A Q03164 4/20 0.58
ALDH1A1 P00352 1/20 0.56
BRCA1 P38398 1/20 0.56
HBB P68871 1/20 0.56
HSD17B10 Q99714 1/20 0.56
RAB9A P51151 1/20 0.54
HAO1 Q9UJM8 2/20 0.51
KMO O15229 1/20 0.46
HRH3 Q9Y5N1 3/20 0.45
HTR2A P28223 1/20 0.44
SLC6A4 P31645 1/20 0.44
CYP3A4 P08684 1/20 0.44
TSHR P16473 1/20 0.44
HSP90AA1 P07900 1/20 0.42
KEAP1 Q14145 1/20 0.42
MPO P05164 1/20 0.41
TPO P07202 1/20 0.41

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
SCHEMBL23926996 0.86 KDM4E (0.78) KDM4EPOLBMEN1KMT2AALDH1A1
SCHEMBL1498279 0.86 KDM4E (0.65) KDM4EPOLBMEN1KMT2AALDH1A1
SCHEMBL30079741 0.86 KDM4E (0.78) KDM4EPOLBMEN1KMT2AALDH1A1
SCHEMBL6306219 0.86 KDM4E (1.00) KDM4EPOLBMEN1KMT2AALDH1A1
SCHEMBL4059342 0.81 KDM4E (0.69) KDM4EPOLBMEN1KMT2AALDH1A1
SCHEMBL2974010 0.80 HAO1 (0.51) KDM4EPOLBMEN1KMT2AHAO1
SCHEMBL8736734 0.80 KDM4E (0.57) KDM4EPOLBMEN1KMT2ARAB9A
SCHEMBL20931746 0.80 KDM4E (0.79) KDM4EPOLBMEN1KMT2AALDH1A1
SCHEMBL5342115 0.79 KDM4E (0.62) KDM4EPOLBMEN1KMT2AALDH1A1
SCHEMBL6506490 0.79 KDM4E (0.68) KDM4EPOLBMEN1KMT2AALDH1A1

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
WO-2005037839-A1 NORCANTHARIDIN DERIVATIVE COMPOUNDS, METHOD FOR THE PRODUCTION THEREOF, COMPOSITIONS CONTAINING SAID COMPOUNDS AND THE USE THEREOF ENTOMED (FR) 2005-04-28 WO disclosed
EP-0072529-B1 SULFUR-SUBSTITUTED PHENOXYPYRIDINES HAVING ANTIVIRAL ACTIVITY THE DOW CHEMICAL COMPANY (US) 1986-01-29 EP disclosed
EP-0072529-A1 Sulfur-substituted phenoxypyridines having antiviral activity THE DOW CHEMICAL COMPANY (US) 1983-02-23 EP disclosed
US-4371537-A Sulfur-substituted phenoxypyridines having antiviral activity THE DOW CHEMICAL COMPANY (US) 1983-02-01 US disclosed