SCHEMBL9575317

SCHEMBL9575317

C1CCC(OCC(COC2CCCC2)OCOC(COC2CCCC2)COC2CCCC2)C1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.34
KDM4E B2RXH2 1/20 0.31
PRMT5 O14744 1/20 0.30
WDR77 Q9BQA1 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
SCHEMBL9575545 0.98 NPC1 (0.38) NPC1KDM4EPRMT5WDR77
SCHEMBL9575677 0.88 KDM4E (0.30) KDM4E
SCHEMBL9575787 0.87 KDM4E (0.32) NPC1KDM4E
SCHEMBL9019792 0.80 EPHX1 (0.31) KDM4E
SCHEMBL9197811 0.78 EPHX1 (0.33) KDM4E
SCHEMBL8077669 0.70 NPC1 (0.37) NPC1KDM4EPRMT5WDR77
SCHEMBL6178354 0.70 NPC1 (0.44) NPC1
SCHEMBL16004201 0.70 NPC1 (0.38) NPC1KDM4EPRMT5WDR77
SCHEMBL16004199 0.70 NPC1 (0.38) NPC1KDM4EPRMT5WDR77
SCHEMBL22692803 0.69 USP2 (0.37) KDM4EPRMT5WDR77

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