Sugi Predict

Sugi Predict / Compounds / SCHEMBL8185778

SCHEMBL8185778

SCHEMBL8185778

Cc1cn([C@H]2CC(CI)[C@@H](CO[Si](c3ccccc3)(c3ccccc3)C(C)(C)C)O2)c(=O)[nH]c1=O

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ TOP2A P11388 6/20 0.58
▸ TK1 P04183 5/20 0.52
▸ RNASE1 P07998 1/20 0.48
▸ TK2 O00142 2/20 0.46

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
SCHEMBL8185775 1.00 TOP2A (0.58) TOP2ATK1RNASE1TK2
SCHEMBL8188888 0.91 TK1 (0.62) TOP2ATK1RNASE1TK2
SCHEMBL7630823 0.91 TOP2A (0.56) TOP2ATK1RNASE1TK2
SCHEMBL8188889 0.91 TK1 (0.62) TOP2ATK1RNASE1TK2
SCHEMBL7623504 0.91 TK1 (0.62) TOP2ATK1RNASE1TK2
SCHEMBL8176653 0.89 TOP2A (0.56) TOP2ATK1RNASE1TK2
SCHEMBL8189898 0.89 TOP2A (0.54) TOP2ATK1RNASE1TK2
SCHEMBL8189902 0.89 TOP2A (0.54) TOP2ATK1RNASE1TK2
SCHEMBL8176647 0.89 TOP2A (0.56) TOP2ATK1RNASE1TK2
SCHEMBL8176132 0.88 TOP2A (0.55) TOP2ATK1RNASE1TK2

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-6087482-A INTER-SUGAR LINKAGES ARE FOUR ATOM LINKING GROUPS; FOR IMPROVED NUCLEASE RESISTANCE AND CELLULAR UPTAKE; FOR DIAGNOSIS AND ANTISENSE THERAPY ISIS PHARMACEUTICALS, INC. (US) 2000-07-11 — — US disclosed
US-5677437-A MACROMOLECULES; REGULATING RNA EXPRESSION; THERAPY ISIS PHARMACEUTICALS, INC. (US) 1997-10-14 — — US disclosed