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SCHEMBL19015102

SCHEMBL19015102

OCCN(CCO)CCOCC(COCC(O)CN(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 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.44
▸ LMNA P02545 1/20 0.37
▸ GAA P10253 3/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ KDM4E B2RXH2 2/20 0.33
▸ NCOA3 Q9Y6Q9 1/20 0.32
▸ MAPT P10636 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ TSHR P16473 1/20 0.30

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 0.94 ALDH1A1 (0.40) ALDH1A1LMNAGAANPSR1KDM4E
SCHEMBL19015100 0.92 ALDH1A1 (0.46) ALDH1A1LMNAGAANPSR1KDM4E
SCHEMBL19015299 0.87 ALDH1A1 (0.40) ALDH1A1LMNAGAANPSR1KDM4E
SCHEMBL23251204 0.87 ALDH1A1 (0.43) ALDH1A1LMNAGAANPSR1KDM4E
SCHEMBL12403339 0.83 ALDH1A1 (0.42) ALDH1A1LMNAGAANPSR1KDM4E
SCHEMBL12270918 0.81 ALDH1A1 (0.43) ALDH1A1LMNAGAANPSR1KDM4E
SCHEMBL19015298 0.77 ALDH1A1 (0.36) ALDH1A1LMNAGAANPSR1
SCHEMBL12510879 0.77 ALDH1A1 (0.40) ALDH1A1LMNAGAANPSR1KDM4E
SCHEMBL12270824 0.75 ALDH1A1 (0.33) ALDH1A1
SCHEMBL18296270 0.74 ALDH1A1 (0.55) ALDH1A1LMNAGAANPSR1KDM4E

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