SCHEMBL760535

SCHEMBL760535

COc1ccc(C(C)(C)c2ccc(OC(=O)Oc3ccc(N4C(=O)c5ccc(-c6ccc7c(c6)C(=O)N(c6ccc(OC(C)=O)cc6)C7=O)cc5C4=O)cc3)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.51
MEN1 O00255 6/20 0.51
KMT2A Q03164 6/20 0.51
ALDH1A1 P00352 2/20 0.47
MET P08581 1/20 0.45
CA9 Q16790 2/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
NPC1 O15118 1/20 0.43
TLR9 Q9NR96 1/20 0.43
HSD17B10 Q99714 1/20 0.43
BACE1 P56817 1/20 0.41
GLA P06280 1/20 0.41
NR1H3 Q13133 1/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL759684 0.92 HSD17B10 (0.54) ESR1MEN1KMT2AALDH1A1NPC1
SCHEMBL13986166 0.80 BACE1 (0.49) MEN1KMT2AALDH1A1HSD17B10BACE1
SCHEMBL10015730 0.80 BACE1 (0.49) MEN1KMT2AALDH1A1HSD17B10BACE1
SCHEMBL14682218 0.80 BACE1 (0.49) MEN1KMT2AALDH1A1HSD17B10BACE1
SCHEMBL15417137 0.80 BACE1 (0.49) MEN1KMT2AALDH1A1HSD17B10BACE1
SCHEMBL14877657 0.80 MEN1 (0.52) ESR1MEN1KMT2AALDH1A1MET
SCHEMBL12639223 0.79 ESR1 (0.72) ESR1MEN1KMT2AALDH1A1MET
SCHEMBL12603929 0.79 LMNA (0.47) MEN1KMT2AALDH1A1HSD17B10BACE1
SCHEMBL760421 0.77 NPSR1 (0.54) MEN1KMT2AALDH1A1NPC1HSD17B10
SCHEMBL11537116 0.77 HSD17B10 (0.61) ESR1MEN1KMT2AALDH1A1CA9

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
US-8426092-B2 Poly(imide-carbonate) polytetrafluoroethylene containing photoconductors XEROX CORPORATION (US) 2013-04-23 US disclosed
US-20120070769-A1 INTERMEDIATE TRANSFER MEMBER XEROX CORPORATION (US) 2012-03-22 US disclosed
US-8138300-B1 Intermediate transfer member XEROX CORPORATION (US) 2012-03-20 US disclosed
US-20120052426-A1 POLY(IMIDE-CARBONATE) POLYTETRAFLUOROETHYLENE CONTAINING PHOTOCONDUCTORS XEROX CORPORATION (US) 2012-03-01 US disclosed