SCHEMBL10886080

SCHEMBL10886080

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

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHCY P23526 4/20 0.62
HIF1A Q16665 1/20 0.62
TMEM97 Q5BJF2 1/20 0.62
SIGMAR1 Q99720 1/20 0.62
QARS1 P47897 2/20 0.58
PRKACA P17612 1/20 0.56
EHMT2 Q96KQ7 2/20 0.55
NNMT P40261 2/20 0.55
NSD2 O96028 2/20 0.54
PCMT1 P22061 2/20 0.54
DOT1L Q8TEK3 2/20 0.54
SETD7 Q8WTS6 2/20 0.54
TRDMT1 O14717 1/20 0.54
PRMT5 O14744 1/20 0.54
RNMT O43148 1/20 0.54
INMT O95050 1/20 0.54
TPMT P51580 1/20 0.54
METTL3 Q86U44 1/20 0.54
CARM1 Q86X55 1/20 0.54
NSD1 Q96L73 1/20 0.54

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
SCHEMBL10885338 0.90 NNMT (0.60) AHCYHIF1ATMEM97SIGMAR1PRKACA
SCHEMBL10883635 0.87 AHCY (0.62) AHCYHIF1ATMEM97SIGMAR1QARS1
SCHEMBL10886589 0.86 AHCY (0.67) AHCYHIF1ATMEM97SIGMAR1HSP90B1
SCHEMBL11203369 0.86 NPEPPS (0.64) AHCYHIF1ATMEM97SIGMAR1EHMT2
SCHEMBL10889028 0.86 NPEPPS (0.64) AHCYHIF1ATMEM97SIGMAR1EHMT2
SCHEMBL10883740 0.86 NPEPPS (0.64) AHCYHIF1ATMEM97SIGMAR1EHMT2
SCHEMBL10887652 0.86 AHCY (0.55) AHCYHIF1ATMEM97SIGMAR1PRKACA
SCHEMBL10884983 0.85 DOT1L (0.59) AHCYHIF1ATMEM97SIGMAR1EHMT2
SCHEMBL11204220 0.85 DOT1L (0.58) AHCYHIF1ATMEM97SIGMAR1EHMT2
SCHEMBL10885975 0.85 DOT1L (0.58) AHCYHIF1ATMEM97SIGMAR1EHMT2

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