SCHEMBL12579947

SCHEMBL12579947

CC[C@H](Nc1ncnc2c1ncn2[C@H]1CC(O)[C@@H](CO)O1)c1ccccc1

nearest known ligand 0.72

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 1/20 0.57
▸ SLC29A1 Q99808 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
SCHEMBL13467240 0.89 HIF1A (0.58) HIF1ASLC29A1
SCHEMBL12579937 0.85 HIF1A (0.54) HIF1ASLC29A1
SCHEMBL25098371 0.84 HIF1A (0.67) HIF1ASLC29A1
SCHEMBL20626254 0.84 ADORA3 (0.73) HIF1ASLC29A1
SCHEMBL20626402 0.84 ADORA3 (0.73) HIF1ASLC29A1
SCHEMBL14714066 0.84 ADORA3 (0.73) HIF1ASLC29A1
SCHEMBL20626165 0.84 ADORA3 (0.73) HIF1ASLC29A1
SCHEMBL20626444 0.84 ADORA3 (0.73) HIF1ASLC29A1
SCHEMBL20626241 0.84 ADORA3 (0.73) HIF1ASLC29A1
SCHEMBL20626445 0.84 ADORA3 (0.73) HIF1ASLC29A1

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-2511283-A1 N6-SUBSTITUTED ADENOSINE DERIVATIVES, N6-SUBSTITUTED ADENINE DERIVATIVES AND USES THEREOF INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF MEDICAL SCIENCES (CN) 2012-10-17 — — EP disclosed
WO-2011069294-A1 N6-SUBSTITUTED ADENOSINE DERIVATIVES, N6-SUBSTITUTED ADENINE DERIVATIVES AND USES THEREOF 中国医学科学院药物研究所 (CN) 2011-06-16 — — WO disclosed
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