SCHEMBL10884755

SCHEMBL10884755

Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)O)[C@@H](NC(=O)c2ccccc2)[C@H]1O

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AHCY P23526 7/20 0.67
▸ TMEM97 Q5BJF2 2/20 0.67
▸ HIF1A Q16665 1/20 0.67
▸ SIGMAR1 Q99720 1/20 0.67
▸ GNMT Q14749 1/20 0.61
▸ HSP90B1 P14625 3/20 0.59
▸ ADORA2A P29274 3/20 0.59
▸ ADORA2B P29275 3/20 0.59
▸ ADORA3 P0DMS8 3/20 0.58
▸ TSHR P16473 2/20 0.57
▸ BLM P54132 2/20 0.57
▸ ADORA1 P30542 2/20 0.57
▸ LMNA P02545 1/20 0.57
▸ THRB P10828 1/20 0.57
▸ KMT2A Q03164 1/20 0.57
▸ HSP90AA1 P07900 1/20 0.57
▸ RXFP1 Q9HBX9 1/20 0.57
▸ HRH1 P35367 1/20 0.57
▸ CYP3A4 P08684 1/20 0.57
▸ MAPK1 P28482 1/20 0.57

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
SCHEMBL11215188 0.88 ADORA2A (0.57) ADORA2AADORA2BADORA3
SCHEMBL10888025 0.88 ADORA2A (0.57) ADORA2AADORA2BADORA3
SCHEMBL14470609 0.87 ADORA3 (0.63) GNMTADORA2AADORA2BADORA3ADORA1
SCHEMBL18402898 0.87 ADORA3 (0.63) GNMTADORA2AADORA2BADORA3ADORA1
SCHEMBL10886624 0.86 AHCY (0.65) AHCYTMEM97HIF1ASIGMAR1HSP90B1
SCHEMBL10886586 0.85 AHCY (0.63) AHCYTMEM97HIF1ASIGMAR1HSP90B1
SCHEMBL10886571 0.85 AHCY (0.63) AHCYTMEM97HIF1ASIGMAR1HSP90B1
SCHEMBL10888062 0.85 AHCY (0.63) AHCYTMEM97HIF1ASIGMAR1HSP90B1
SCHEMBL10884413 0.85 AHCY (0.67) AHCYTMEM97HIF1ASIGMAR1HSP90B1
SCHEMBL10886149 0.84 AHCY (0.63) AHCYTMEM97HIF1ASIGMAR1GNMT

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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