SCHEMBL17324142

SCHEMBL17324142

CCCC(O)CN(CCCO)CC(O)COc1ccc(C(C)(C)c2ccc(OC)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 1/20 0.53
▸ HIF1A Q16665 1/20 0.53
▸ KDM4E B2RXH2 1/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ AR P10275 1/20 0.46
▸ ALDH1A1 P00352 3/20 0.45
▸ LMNA P02545 2/20 0.45
▸ GAA P10253 3/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ TSHR P16473 1/20 0.41
▸ NCOA3 Q9Y6Q9 1/20 0.40
▸ ABCB11 O95342 1/20 0.39
▸ KCNH2 Q12809 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39

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
SCHEMBL1101535 0.85 HTT (0.61) HTTHIF1AKDM4EMAPK1TDP1
SCHEMBL14595232 0.83 HTT (0.61) HTTHIF1AKDM4EMAPK1AR
SCHEMBL18120597 0.81 KDM4E (0.71) HTTHIF1AKDM4EMAPK1TDP1
SCHEMBL1101566 0.80 HTT (0.55) HTTHIF1AKDM4EMAPK1TDP1
SCHEMBL1101870 0.79 HTT (0.60) HTTHIF1AKDM4EMAPK1TDP1
SCHEMBL11650773 0.78 HTT (0.68) HTTHIF1AKDM4EMAPK1TDP1
SCHEMBL22745504 0.77 HTT (0.52) HTTHIF1AKDM4EMAPK1TDP1
SCHEMBL1708894 0.77 HTT (0.65) HTTHIF1AKDM4EMAPK1AR
SCHEMBL14196580 0.76 HTT (0.56) HTTHIF1AKDM4EMAPK1TDP1
SCHEMBL801366 0.76 HTT (0.60) HTTHIF1AKDM4EMAPK1AR

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-20160244550-A1 HYBRID EPOXY-AMINE HYDROXYURETHANE-GRAFTED POLYMER POLYMATE LTD (IL) 2016-08-25 — — US disclosed
US-20160244563-A1 HYBRID EPOXY-AMINE HYDROXYURETHANE-GRAFTED POLYMER POLYMATE LTD (IL) 2016-08-25 — — US disclosed
US-20160244551-A1 HYBRID EPOXY-AMINE HYDROXYURETHANE-GRAFTED POLYMER POLYMATE LTD (IL) 2016-08-25 — — US disclosed
US-20150353683-A1 HYBRID EPOXY-AMINE HYDROXYURETHANE-GRAFTED POLYMER NANOTECH INDUSTRIES, INC. 2015-12-10 — — US disclosed
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