SCHEMBL19015299

SCHEMBL19015299

CCCOCC(COCCCN(CCO)CCO)(COCC(O)CN(CCO)CCO)COCC(COCC(O)CN(CCO)CCO)(COCC(O)CN(CCO)CCO)COCC(O)CN(CCO)CCO

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
LMNA P02545 2/20 0.36
USP2 O75604 1/20 0.36
KDM4E B2RXH2 1/20 0.34
MAPK1 P28482 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
GAA P10253 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
HTT P42858 1/20 0.32
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL19015103 0.93 ALDH1A1 (0.40) ALDH1A1LMNAUSP2KDM4ENPSR1
SCHEMBL19015102 0.87 ALDH1A1 (0.44) ALDH1A1LMNAKDM4EMAPK1NPSR1
SCHEMBL19015100 0.85 ALDH1A1 (0.46) ALDH1A1LMNAKDM4EMAPK1NPSR1
SCHEMBL23251204 0.81 ALDH1A1 (0.43) ALDH1A1LMNAKDM4EMAPK1NPSR1
SCHEMBL12270918 0.81 ALDH1A1 (0.43) ALDH1A1LMNAUSP2KDM4EMAPK1
SCHEMBL757371 0.78 USP2 (0.53) ALDH1A1LMNAUSP2KDM4EMAPK1
SCHEMBL12510879 0.77 ALDH1A1 (0.40) ALDH1A1LMNAKDM4EMAPK1TDP1
SCHEMBL12403339 0.77 ALDH1A1 (0.42) ALDH1A1LMNAKDM4EMAPK1NPSR1
SCHEMBL18296270 0.76 ALDH1A1 (0.55) ALDH1A1LMNAUSP2KDM4EMAPK1
SCHEMBL2991718 0.75 USP2 (0.64) ALDH1A1LMNAUSP2KDM4EMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017100856-A1 DENDRIMER AND FORMULATIONS THEREOF STARPHARMA PTY LTD (AU) 2017-06-22 WO disclosed