SCHEMBL10885676

SCHEMBL10885676

CC(C)(C)OC(=O)NC(CCC(=O)OCc1ccccc1)C(=O)N[C@H]1[C@@H](O)[C@H](n2cnc3c(N)ncnc32)O[C@@H]1C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
AHCY P23526 5/20 0.55
NPEPPS P55786 3/20 0.50
DOT1L Q8TEK3 5/20 0.48
HIF1A Q16665 1/20 0.46
TMEM97 Q5BJF2 1/20 0.46
SIGMAR1 Q99720 1/20 0.46
HSP90B1 P14625 1/20 0.45
PLA2G2A P14555 1/20 0.45

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
SCHEMBL10883635 0.86 AHCY (0.62) AHCYNPEPPSDOT1LHIF1ATMEM97
SCHEMBL10885233 0.85 AHCY (0.62) AHCYDOT1LHIF1ATMEM97SIGMAR1
SCHEMBL10887149 0.85 AHCY (0.62) AHCYDOT1LHIF1ATMEM97SIGMAR1
SCHEMBL10887920 0.84 DOT1L (0.62) AHCYDOT1LHIF1ATMEM97SIGMAR1
SCHEMBL10883811 0.83 AHCY (0.63) AHCYDOT1LHIF1ATMEM97SIGMAR1
SCHEMBL11060590 0.83 NPEPPS (0.51) AHCYNPEPPSDOT1LHIF1ATMEM97
SCHEMBL10884594 0.82 NPEPPS (0.50) AHCYNPEPPSDOT1LHIF1ATMEM97
SCHEMBL10884634 0.82 AHCY (0.56) AHCYNPEPPSDOT1LHIF1APLA2G2A
SCHEMBL11052636 0.82 AHCY (0.57) AHCYDOT1LHIF1ATMEM97SIGMAR1
SCHEMBL11063608 0.81 NPEPPS (0.48) AHCYNPEPPSDOT1LHIF1ATMEM97

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0071926-B1 NEW RIBOFURANURONIC ACID DERIVATIVES, PROCESSES FOR PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-10-08 EP disclosed
US-4479942-A Tetrahydrofurnancarboxylic acid derivatives, processes for preparation thereof and pharmaceutical compositions thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-10-30 US disclosed
EP-0071926-A1 New ribofuranuronic acid derivatives, processes for preparation thereof and pharmaceutical compositions thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-02-16 EP disclosed