SCHEMBL7423016

SCHEMBL7423016

COc1ccccc1-c1cccc(O)c1OC

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.57
CA2 P00918 3/20 0.57
TP53 P04637 2/20 0.57
TSHR P16473 1/20 0.57
ALDH1A1 P00352 2/20 0.55
ALOX15 P16050 2/20 0.55
KDM4E B2RXH2 1/20 0.55
LMNA P02545 1/20 0.55
CYP3A4 P08684 1/20 0.55
MAPT P10636 1/20 0.55
HPGD P15428 1/20 0.55
ALOX12 P18054 1/20 0.55
MAPK1 P28482 1/20 0.55
HSD17B10 Q99714 1/20 0.55
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
HDAC4 P56524 1/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
APP P05067 1/20 0.46

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
SCHEMBL6536005 0.90 KDM4E (0.57) CA1CA2TP53TSHRALDH1A1
SCHEMBL21815270 0.88 CA1 (0.55) CA1CA2TP53TSHRALDH1A1
SCHEMBL4398788 0.84 TP53 (0.67) CA1CA2TP53TSHRALDH1A1
SCHEMBL30237826 0.82 ALDH1A1 (0.69) CA1CA2TP53TSHRALDH1A1
SCHEMBL186826 0.81 MAPT (0.67) CA1CA2TP53TSHRALDH1A1
SCHEMBL28313490 0.81 CYP1A1 (0.56) CA1CA2TP53ALDH1A1ALOX15
SCHEMBL27632073 0.80 MEN1 (0.62) CA1CA2TP53TSHRALDH1A1
SCHEMBL3898449 0.79 MAPT (0.64) CA1CA2TP53TSHRALDH1A1
SCHEMBL3899924 0.79 MAPT (0.64) CA1CA2TP53TSHRALDH1A1
Hydrochloric Acid SCHEMBL22291108 0.79 TP53 (0.64) CA1CA2TP53TSHRALDH1A1

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-1183239-A1 AROMATIC SULFONE HYDROXAMIC ACID METALLOPROTEASE INHIBITOR G.D. SEARLE & CO. (US) 2002-03-06 EP disclosed
WO-2000069821-A1 AROMATIC SULFONE HYDROXAMIC ACID METALLOPROTEASE INHIBITOR G.D. SEARLE & CO. (US) 2000-11-23 WO disclosed
US-4792570-A 3- and 4-biphenyloxyaminoalkanes and related compounds as anti-inflammatory and analgetic agents SYNTEX (U.S.A.) INC. (US) 1988-12-20 US disclosed
EP-0157652-A1 2-, 3- And 4-biphenyloxyaminoalkanes and related compounds, their preparation and uses, and pharmaceutical compositions containing them SYNTEX (U.S.A.) INC. (US) 1985-10-09 EP disclosed