SCHEMBL263531

SCHEMBL263531

COC(=O)C[C@@H](CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)NC(=O)OCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.47
CTRB1 P17538 2/20 0.46
CTSL P07711 3/20 0.43
CTSS P25774 3/20 0.43
CTSB P07858 2/20 0.43
ATM Q13315 1/20 0.43
CASP1 P29466 4/20 0.43
ALDH1A1 P00352 1/20 0.43
ALOX15 P16050 1/20 0.43
KYNU Q16719 1/20 0.42
CTSK P43235 4/20 0.42
REN P00797 1/20 0.41
TRPM8 Q7Z2W7 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
SCHEMBL29666577 0.93 SYK (0.44) SYKCTRB1CTSLCTSSCTSB
SCHEMBL26978909 0.92 SYK (0.53) SYKCTRB1CTSLCTSSCTSB
SCHEMBL27125801 0.92 SYK (0.53) SYKCTRB1CTSLCTSSCTSB
SCHEMBL261847 0.91 SYK (0.48) SYKCTRB1CTSLCTSSCTSB
SCHEMBL5724195 0.91 SYK (0.52) SYKCTRB1CTSLCTSSCTSB
SCHEMBL26979932 0.88 SYK (0.46) SYKCTRB1CTSLCTSSCTSB
SCHEMBL27125076 0.88 SYK (0.46) SYKCTRB1CTSLCTSSCTSB
SCHEMBL5724348 0.88 SYK (0.57) SYKCTRB1CTSLCTSSCTSB
SCHEMBL5724356 0.88 SYK (0.49) SYKCTRB1CTSLCTSSCTSB
SCHEMBL5221861 0.88 SYK (0.50) SYKCTSLCTSSCTSBATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8133908-B2 Heteroaryl derivatives of N-{[(1S,4S,6S)-3-(2-pyridinylcarbonyl)-3-azabicyclo[4.1.0]hept-4-yl]methyl}-2-amine GLAXO GROUP LIMITED (GB) 2012-03-13 US disclosed
US-8133908-B2 Heteroaryl derivatives of N-{[(1S,4S,6S)-3-(2-pyridinylcarbonyl)-3-azabicyclo[4.1.0]hept-4-yl]methyl}-2-amine GLAXO GROUP LIMITED (GB) 2012-03-13 US disclosed
EP-2370427-A1 N-{[(IR,4S,6R-3-(2-PYRIDINYLCARBONYL)-3-AZABICYCLO [4.1.0]HEPT-4-YL]METHYL}-2-HETEROARYLAMINE DERIVATIVES AND USES THEREOF Glaxo Group Limited (GB) 2011-10-05 EP disclosed
US-20100168131-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2010-07-01 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-20100168131-A1 NOVEL COMPOUNDS HTR3B, HNMT, TPMT SYK 3387/4885CTRB1 4356/4885CTSL 1788/4885

“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.