SCHEMBL7209902

SCHEMBL7209902

CC(C)(C)[Si](c1ccccc1)(c1ccccc1)C(O)[C@H]1O[C@@H](C(C#N)NC(=O)OCc2ccccc2)[C@H](O)[C@@H]1O

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CTSS P25774 13/20 0.43
▸ CTSL P07711 13/20 0.43
▸ CTSB P07858 7/20 0.43
▸ TACR1 P25103 2/20 0.41
▸ CTSK P43235 7/20 0.40
▸ ATM Q13315 1/20 0.40

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
SCHEMBL7209504 0.80 TACR1 (0.45) CTSSCTSLCTSBTACR1CTSK
SCHEMBL7209268 0.77 CTSS (0.41) CTSSCTSLCTSBTACR1CTSK
SCHEMBL27450139 0.69 TACR1 (0.53) CTSSCTSLCTSBTACR1CTSK
SCHEMBL498416 0.68 SYK (0.58) CTSSCTSLCTSBTACR1CTSK
SCHEMBL4119423 0.67 CTSS (0.59) CTSSCTSLCTSBTACR1CTSK
SCHEMBL1610207 0.67 CTSS (0.59) CTSSCTSLCTSBTACR1CTSK
SCHEMBL24852467 0.66 CTSS (0.60) CTSSCTSLCTSBTACR1CTSK
SCHEMBL1186365 0.66 CTSS (0.60) CTSSCTSLCTSBTACR1CTSK
SCHEMBL6311732 0.66 CTSS (0.62) CTSSCTSLCTSBTACR1CTSK
SCHEMBL6312473 0.66 CTSS (0.62) CTSSCTSLCTSBTACR1CTSK

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-6617106-B1 Methods for preparing oligonucleotides containing non-standard nucleotides BENNER, STEVEN 2003-09-09 — — US disclosed
US-6140496-A Precursors for deoxyribonucleotides containing non-standard nucleosides BENNER, STEVEN 2000-10-31 — — US disclosed
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