SCHEMBL1334874

SCHEMBL1334874

CC(O[Si](C)(C)C(C)(C)C)C(NC(=O)OC(C)(C)C)C(O)=S

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CTSK P43235 7/20 0.42
CTSS P25774 4/20 0.42
PREP P48147 1/20 0.40
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
KMT2A Q03164 1/20 0.36
TRPA1 O75762 1/20 0.36
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CYP2D6 P10635 1/20 0.35
CTSL P07711 2/20 0.35
CTSB P07858 2/20 0.35
MAPT P10636 1/20 0.32
ATM Q13315 1/20 0.32
ALDH1A1 P00352 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL26656112 0.88 CTSK (0.43) CTSKCTSSPREPCA1CA2
SCHEMBL15228678 0.88 CTSK (0.43) CTSKCTSSPREPCA1CA2
SCHEMBL20701884 0.88 CTSK (0.43) CTSKCTSSPREPCA1CA2
SCHEMBL15228429 0.88 CTSK (0.43) CTSKCTSSPREPCA1CA2
SCHEMBL1334871 0.84 CTSK (0.40) CTSKCTSSPREPCA1CA2
SCHEMBL22527160 0.84 CTSK (0.40) CTSKCTSSPREPCA1CA2
SCHEMBL15228716 0.84 CTSK (0.40) CTSKCTSSPREPCA1CA2
SCHEMBL15228718 0.84 CTSK (0.40) CTSKCTSSPREPCA1CA2
SCHEMBL7056042 0.84 CTSK (0.40) CTSKCTSSPREPCA1CA2
SCHEMBL26207740 0.84 CTSK (0.40) CTSKCTSSPREPCA1CA2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110282081-A1 Methods of Preparing 1-Deoxy-Sphingoid Bases and Derivatives Thereof EMORY UNIVERSITY (US) 2011-11-17 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110282081-A1 Methods of Preparing 1-Deoxy-Sphingoid Bases and Derivatives Thereof DEGS1, SPHK1, SPHK2 CTSK 2820/4885CTSS 2526/4885PREP 2806/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.