SCHEMBL8761320

SCHEMBL8761320

CSc1nc(N)c2c(C)cn([C@H]3OC(CO)[C@@H](O)[C@H]3O)c2n1

nearest known ligand 0.66

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.53
▸ PKM P14618 1/20 0.53
▸ ADORA3 P0DMS8 7/20 0.48
▸ ADK P55263 2/20 0.47
▸ DOT1L Q8TEK3 1/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ GALR3 O60755 1/20 0.47
▸ S1PR4 O95977 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ S1PR1 P21453 1/20 0.47
▸ HTT P42858 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ PAX8 Q06710 1/20 0.47

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
SCHEMBL1905991 0.87 KDM4E (0.53) KDM4EPKMADK
SCHEMBL1907078 0.80 KDM4E (0.49) KDM4EPKMADORA3ADKDOT1L
SCHEMBL17816342 0.80 ADK (0.72) KDM4EADORA3ADKDOT1LNPC1
SCHEMBL13065703 0.80 ADK (0.72) KDM4EADORA3ADKDOT1LNPC1
SCHEMBL20419279 0.80 ADK (0.72) KDM4EADORA3ADKDOT1LNPC1
SCHEMBL18089839 0.79 ADORA3 (0.73) ADORA3
SCHEMBL2461484 0.79 ADORA3 (0.73) ADORA3
SCHEMBL10073439 0.79 ADORA3 (0.73) ADORA3
SCHEMBL2461486 0.79 ADORA3 (0.73) ADORA3
SCHEMBL14428970 0.79 ADK (0.71) KDM4EADORA3ADKDOT1LNPC1

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-0691980-B1 7-DEAZAPURINE MODIFIED OLIGONUCLEOTIDES SANOFI SA (FR) 1997-06-04 — — EP disclosed
WO-1994022892-A1 7-DEAZAPURINE MODIFIED OLIGONUCLEOTIDES STERLING WINTHROP INC. (US) 1994-10-13 — — WO disclosed
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