SCHEMBL7520975

SCHEMBL7520975

O=C(O)CNC(=O)c1ccc(O)c(O)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 1/20 0.58
KDM4E B2RXH2 3/20 0.58
MAPT P10636 3/20 0.58
HIF1A Q16665 1/20 0.58
SLC22A6 Q4U2R8 1/20 0.58
SLC22A8 Q8TCC7 1/20 0.58
CA1 P00915 4/20 0.56
CA2 P00918 4/20 0.56
MAPK1 P28482 1/20 0.55
TOP1 P11387 3/20 0.55
PTPRC P08575 2/20 0.54
CTSL P07711 1/20 0.54
PTPN13 Q12923 1/20 0.54
GAA P10253 2/20 0.53
CA12 O43570 2/20 0.53
CA7 P43166 2/20 0.53
CA9 Q16790 2/20 0.53
CA14 Q9ULX7 2/20 0.53
POLB P06746 1/20 0.53
CA4 P22748 1/20 0.53

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
SCHEMBL11672759 0.86 EGLN1 (0.61) KDM4EMAPTHIF1ASLC22A6SLC22A8
SCHEMBL29195031 0.84 KDM4E (0.53) KDM4EMAPTHIF1ASLC22A6SLC22A8
SCHEMBL6337602 0.84 CA1 (0.55) HDAC6KDM4EMAPTHIF1ASLC22A6
SCHEMBL29195064 0.84 CA2 (0.62) KDM4EMAPTHIF1ASLC22A6SLC22A8
SCHEMBL3187483 0.82 SIRT5 (0.58) HDAC6KDM4EMAPTCA1CA2
SCHEMBL11107537 0.82 KDM4E (0.80) HDAC6KDM4EMAPTHIF1ASLC22A6
SCHEMBL16144996 0.81 KDM4E (0.59) KDM4EMAPTHIF1ASLC22A6SLC22A8
SCHEMBL23067305 0.81 HDAC6 (0.53) HDAC6KDM4EMAPTHIF1ACA1
SCHEMBL31465194 0.80 HTT (0.61) HDAC6KDM4EMAPTHIF1ASLC22A6
SCHEMBL6138174 0.80 HTT (0.61) HDAC6KDM4EMAPTHIF1ASLC22A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6362165-B1 Hydroxyphenyl derivatives with HIV integrase inhibitory properties PHARMACOR INC. (CA) 2002-03-26 US disclosed
EP-1165492-A1 HYDROXYPHENYL DERIVATIVES WITH HIV INTEGRASE INHIBITORY PROPERTIES Pharmacor Inc. (CA) 2002-01-02 EP disclosed
WO-2000059867-A1 HYDROXYPHENYL DERIVATIVES WITH HIV INTEGRASE INHIBITORY PROPERTIES PHARMACOR INC. (CA) 2000-10-12 WO disclosed