SCHEMBL14156815

SCHEMBL14156815

CSc1nc(N)nc2c1ncn2C1CC(O)C(CO)O1

nearest known ligand 0.65

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.65
▸ HBB P68871 1/20 0.65
▸ PNP P00491 1/20 0.62
▸ LMNA P02545 1/20 0.62
▸ TP53 P04637 1/20 0.62
▸ HTT P42858 1/20 0.62
▸ PDE4D Q08499 1/20 0.62
▸ PDE3A Q14432 1/20 0.62
▸ SMN1; SMN2 Q16637 1/20 0.62
▸ RXFP1 Q9HBX9 1/20 0.62
▸ ADRB1 P08588 1/20 0.56
▸ DNMT1 P26358 1/20 0.56
▸ HIF1A Q16665 1/20 0.55
▸ SLC29A1 Q99808 5/20 0.53
▸ PIM1 P11309 1/20 0.51
▸ CSNK2A2 P19784 1/20 0.51
▸ CSNK2B P67870 1/20 0.51
▸ CSNK2A1 P68400 1/20 0.51
▸ CSNK2A3 Q8NEV1 1/20 0.51

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
SCHEMBL9346544 0.91 PNP (0.65) CYP1A2HBBPNPLMNATP53
SCHEMBL9346554 0.91 PNP (0.65) CYP1A2HBBPNPLMNATP53
SCHEMBL5982123 0.88 HIF1A (0.59) CYP1A2HBBPNPLMNATP53
SCHEMBL5982127 0.88 HIF1A (0.59) CYP1A2HBBPNPLMNATP53
SCHEMBL21795436 0.88 CYP1A2 (0.64) CYP1A2HBBPNPLMNATP53
SCHEMBL21795432 0.88 CYP1A2 (0.64) CYP1A2HBBPNPLMNATP53
SCHEMBL21795433 0.88 CYP1A2 (0.64) CYP1A2HBBPNPLMNATP53
SCHEMBL21795365 0.87 CYP1A2 (0.61) CYP1A2HBBPNPLMNATP53
SCHEMBL21795366 0.87 CYP1A2 (0.61) CYP1A2HBBPNPLMNATP53
SCHEMBL23982120 0.85 PNP (0.79) CYP1A2HBBPNPLMNATP53

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
US-7385051-B2 Fluorescent N2,N3-etheno-purine (2′-deoxy) riboside derivatives and uses thereof BAR-LLAN UNIVERSITY (IL) 2008-06-10 — — US disclosed
US-7385051-B2 Fluorescent N2,N3-etheno-purine (2′-deoxy) riboside derivatives and uses thereof BAR-LLAN UNIVERSITY (IL) 2008-06-10 — — US disclosed
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