SCHEMBL15550285

SCHEMBL15550285

CCOC(=O)c1c2c(c(C(=O)OCc3ccccc3)n1CC)OCCO2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.47
TDP1 Q9NUW8 2/20 0.47
SLC6A2 P23975 1/20 0.47
SLC6A3 Q01959 1/20 0.47
RAB9A P51151 3/20 0.45
NPC1 O15118 2/20 0.45
ALDH1A1 P00352 6/20 0.44
MAPT P10636 5/20 0.44
GAA P10253 4/20 0.44
LMNA P02545 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
TSHR P16473 4/20 0.43
MAPK1 P28482 2/20 0.43
HPGD P15428 1/20 0.42
CHRM2 P08172 1/20 0.41
CHRM4 P08173 1/20 0.41
CHRM5 P08912 1/20 0.41
CHRM1 P11229 1/20 0.41
CHRM3 P20309 1/20 0.41
ADORA3 P0DMS8 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
SCHEMBL2931696 0.86 ALDH1A1 (0.54) KMT2ATDP1ALDH1A1MAPTGAA
SCHEMBL11408485 0.75 KMT2A (0.76) KMT2ATDP1SLC6A2SLC6A3RAB9A
SCHEMBL1127122 0.73 MAPT (0.53) KMT2ATDP1SLC6A2SLC6A3RAB9A
SCHEMBL2930130 0.73 TSHR (0.48) KMT2ATDP1ALDH1A1MAPTGAA
SCHEMBL8861145 0.72 KMT2A (0.45) KMT2ATDP1SLC6A2SLC6A3RAB9A
SCHEMBL2723479 0.72 MAPK8 (0.51) KMT2ATDP1ALDH1A1MAPTGAA
SCHEMBL660947 0.72 TSHR (0.75) KMT2ATDP1SLC6A2SLC6A3RAB9A
SCHEMBL22946135 0.72 TDP1 (0.51) KMT2ATDP1SLC6A2SLC6A3RAB9A
SCHEMBL6044463 0.71 HSD17B10 (0.46) KMT2ARAB9ANPC1MAPTGAA
SCHEMBL8617200 0.71 ALDH1A1 (0.48) KMT2ATDP1SLC6A2SLC6A3RAB9A

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-2016126815-A1 THERMAL MANAGEMENT FILMS CONTAINING PHASE CHANGE MATERIALS Outlast Technologies, LLC (US) 2016-08-11 WO disclosed
WO-2016126817-A1 SYSTEMS, STRUCTURES AND MATERIALS FOR ELECTROCHEMICAL DEVICE THERMAL MANAGEMENT Outlast Technologies, LLC (US) 2016-08-11 WO disclosed
EP-2877803-A2 SYSTEMS, STRUCTURES AND MATERIALS FOR ELECTRONIC DEVICE COOLING Outlast Technologies LLC (US) 2015-06-03 EP disclosed
WO-2014018491-A2 SYSTEMS, STRUCTURES AND MATERIALS FOR ELECTRONIC DEVICE COOLING Outlast Technologies, LLC (US) 2014-01-30 WO disclosed