SCHEMBL9575787

SCHEMBL9575787

CC(C)OCC(COC1CCCCC1)OCOC(COC(C)C)COC1CCCCC1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.32
NPC1 O15118 1/20 0.32
ALDH1A1 P00352 1/20 0.30
MAPT P10636 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
SCHEMBL9575677 0.98 KDM4E (0.30) KDM4E
SCHEMBL9575545 0.89 NPC1 (0.38) KDM4ENPC1ALDH1A1MAPT
SCHEMBL9575317 0.87 NPC1 (0.34) KDM4ENPC1
SCHEMBL13641881 0.77 NPC1 (0.38) KDM4ENPC1ALDH1A1
SCHEMBL11884189 0.77 NPC1 (0.38) KDM4ENPC1ALDH1A1
SCHEMBL11878686 0.77 NPC1 (0.38) KDM4ENPC1ALDH1A1
SCHEMBL11879526 0.77 NPC1 (0.38) KDM4ENPC1ALDH1A1
SCHEMBL11884103 0.77 NPC1 (0.38) KDM4ENPC1ALDH1A1
SCHEMBL11878724 0.77 NPC1 (0.38) KDM4ENPC1ALDH1A1
SCHEMBL6988663 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5225550-A PROCESS FOR THE PREPARATION OF SUBSTITUTED ACYCLIC NUCLEOSIDES, AND INTERMEDIATES OCCURRING THEREIN HOECHST AKTIENGESELLSCHAFT (DE) 1993-07-06 US disclosed
EP-0464511-A2 Process for the preparation of acyclic, substituted nucleosides and its intermediates HOECHST AKTIENGESELLSCHAFT (DE) 1992-01-08 EP disclosed