SCHEMBL10886606

SCHEMBL10886606

CC(=O)N(c1ccccc1)[C@H]1[C@@H](O)[C@H](n2cnc3c(N)ncnc32)O[C@@H]1C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ AHCY P23526 9/20 0.65
▸ HIF1A Q16665 1/20 0.65
▸ TMEM97 Q5BJF2 1/20 0.65
▸ SIGMAR1 Q99720 1/20 0.65
▸ ADORA2B P29275 4/20 0.57
▸ HSP90B1 P14625 3/20 0.57
▸ ADORA2A P29274 2/20 0.57
▸ ADORA3 P0DMS8 5/20 0.56
▸ TSHR P16473 2/20 0.56
▸ LMNA P02545 1/20 0.56
▸ THRB P10828 1/20 0.56
▸ BLM P54132 1/20 0.56
▸ KMT2A Q03164 1/20 0.56
▸ HSP90AA1 P07900 1/20 0.56
▸ ADORA1 P30542 1/20 0.56
▸ CYP2C19 P33261 1/20 0.53

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
SCHEMBL10886173 0.90 AHCY (0.64) AHCYHIF1ATMEM97SIGMAR1ADORA2B
SCHEMBL10883310 0.84 ADORA2A (0.54) ADORA2BADORA2AADORA3
SCHEMBL10885019 0.83 DOT1L (0.54) AHCYHIF1ATMEM97SIGMAR1ADORA2B
SCHEMBL11198776 0.83 DOT1L (0.54) AHCYHIF1ATMEM97SIGMAR1ADORA2B
5'-Carboxy Adenosine SCHEMBL2117257 0.80 AHCY (1.00) AHCYHIF1ATMEM97SIGMAR1ADORA2B
5'-Carboxy Adenosine SCHEMBL3815016 0.80 AHCY (1.00) AHCYHIF1ATMEM97SIGMAR1ADORA2B
5'-Carboxy Adenosine SCHEMBL29376409 0.80 AHCY (1.00) AHCYHIF1ATMEM97SIGMAR1ADORA2B
5'-Carboxy Adenosine SCHEMBL2117314 0.80 AHCY (1.00) AHCYHIF1ATMEM97SIGMAR1ADORA2B
5'-Carboxy Adenosine SCHEMBL8981282 0.80 AHCY (1.00) AHCYHIF1ATMEM97SIGMAR1ADORA2B
SCHEMBL11197673 0.78 AHCY (0.57) AHCYHIF1ATMEM97SIGMAR1ADORA2B

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
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