SCHEMBL10885975

SCHEMBL10885975

Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)O)[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)[C@H]1O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DOT1L Q8TEK3 1/20 0.58
AHCY P23526 4/20 0.58
HIF1A Q16665 2/20 0.58
TMEM97 Q5BJF2 1/20 0.58
SIGMAR1 Q99720 1/20 0.58
NPEPPS P55786 3/20 0.56
ATM Q13315 1/20 0.56
SMN1; SMN2 Q16637 3/20 0.54
TP53 P04637 2/20 0.54
CYP3A4 P08684 2/20 0.54
ANPEP P15144 1/20 0.54
LMNA P02545 1/20 0.54
HTT P42858 1/20 0.53
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
PAX8 Q06710 1/20 0.53
EHMT2 Q96KQ7 1/20 0.52
HSP90B1 P14625 1/20 0.51
ADORA2A P29274 1/20 0.51
ADORA2B P29275 1/20 0.51

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
SCHEMBL11204220 1.00 DOT1L (0.58) DOT1LAHCYHIF1ATMEM97SIGMAR1
SCHEMBL10884983 0.94 DOT1L (0.59) DOT1LAHCYHIF1ATMEM97SIGMAR1
SCHEMBL10889028 0.93 NPEPPS (0.64) DOT1LAHCYHIF1ATMEM97SIGMAR1
SCHEMBL11203369 0.93 NPEPPS (0.64) DOT1LAHCYHIF1ATMEM97SIGMAR1
SCHEMBL10883740 0.93 NPEPPS (0.64) DOT1LAHCYHIF1ATMEM97SIGMAR1
SCHEMBL10887152 0.93 DOT1L (0.57) DOT1LAHCYHIF1ATMEM97SIGMAR1
SCHEMBL10883905 0.93 DOT1L (0.57) DOT1LAHCYHIF1ATMEM97SIGMAR1
SCHEMBL10886296 0.91 SMN1; SMN2 (0.66) DOT1LAHCYHIF1ATMEM97SIGMAR1
SCHEMBL11198593 0.91 SMN1; SMN2 (0.66) DOT1LAHCYHIF1ATMEM97SIGMAR1
SCHEMBL10885652 0.90 TRDMT1 (0.58) DOT1LAHCYHIF1ATMEM97SIGMAR1

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