SCHEMBL10889236

SCHEMBL10889236

Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC=O)[C@H]1O

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AHCY P23526 6/20 0.57
HIF1A Q16665 1/20 0.56
TMEM97 Q5BJF2 1/20 0.56
SIGMAR1 Q99720 1/20 0.56
ADORA2A P29274 4/20 0.55
ADORA2B P29275 4/20 0.55
NPEPPS P55786 1/20 0.51
DOT1L Q8TEK3 1/20 0.51
PRKACA P17612 2/20 0.50
CARM1 Q86X55 1/20 0.49

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
SCHEMBL10883740 0.89 NPEPPS (0.64) AHCYHIF1ATMEM97SIGMAR1ADORA2A
SCHEMBL11203369 0.89 NPEPPS (0.64) AHCYHIF1ATMEM97SIGMAR1ADORA2A
SCHEMBL10889028 0.89 NPEPPS (0.64) AHCYHIF1ATMEM97SIGMAR1ADORA2A
SCHEMBL10885233 0.87 AHCY (0.62) AHCYHIF1ATMEM97SIGMAR1ADORA2A
SCHEMBL10887149 0.87 AHCY (0.62) AHCYHIF1ATMEM97SIGMAR1ADORA2A
SCHEMBL11052636 0.83 AHCY (0.57) AHCYHIF1ATMEM97SIGMAR1ADORA2A
SCHEMBL10886624 0.83 AHCY (0.65) AHCYHIF1ATMEM97SIGMAR1ADORA2A
SCHEMBL10884983 0.83 DOT1L (0.59) AHCYHIF1ATMEM97SIGMAR1ADORA2A
SCHEMBL10888062 0.82 AHCY (0.63) AHCYHIF1ATMEM97SIGMAR1ADORA2A
SCHEMBL10884634 0.82 AHCY (0.56) AHCYHIF1AADORA2AADORA2BNPEPPS

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
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