SCHEMBL8826261

SCHEMBL8826261

OC[C@H]1O[C@@H](n2cnc3c(OCC4CC4)ncnc32)C[C@@H]1F

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 1/20 0.49
▸ SLC29A1 Q99808 1/20 0.43
▸ EGFR P00533 1/20 0.41
▸ ERBB2 P04626 1/20 0.41

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
SCHEMBL8826276 0.85 PNP (0.46) SLC29A1
SCHEMBL9360335 0.85 PNP (0.46) SLC29A1
SCHEMBL8939241 0.83 HIF1A (0.52) HIF1ASLC29A1EGFRERBB2
SCHEMBL8826156 0.83 SLC29A1 (0.65) HIF1ASLC29A1
SCHEMBL5199003 0.81 HIF1A (0.56) HIF1AEGFRERBB2
SCHEMBL5198998 0.81 HIF1A (0.56) HIF1AEGFRERBB2
SCHEMBL8826350 0.80 SLC29A1 (0.51) HIF1ASLC29A1
SCHEMBL4745554 0.80 EGFR (0.61) HIF1ASLC29A1EGFRERBB2
SCHEMBL4745556 0.80 EGFR (0.61) HIF1ASLC29A1EGFRERBB2
SCHEMBL21133221 0.80 EGFR (0.61) HIF1ASLC29A1EGFRERBB2

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-5663154-A VIRICIDES, HIV, HEPATITIS GLAXO WELLCOME INC. (US) 1997-09-02 — — US disclosed
WO-1993014103-A1 THERAPEUTIC NUCLEOSIDES THE WELLCOME FOUNDATION LIMITED (GB) 1993-07-22 — — WO disclosed
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