SCHEMBL17664705

SCHEMBL17664705

C[C@@H]1[C@@H](C)C=CCN1C(=O)OC(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PREP P48147 1/20 0.38
CHRM2 P08172 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36
USP2 O75604 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CTSK P43235 1/20 0.34
HSD17B10 Q99714 1/20 0.34
LMNA P02545 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
NR1H2 P55055 1/20 0.33
CYP1A2 P05177 1/20 0.33
POLB P06746 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C19 P33261 1/20 0.33
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
MAPK1 P28482 1/20 0.33

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
SCHEMBL1639677 0.83 PREP (0.39) PREPCHRM2CHRM1CHRM3USP2
SCHEMBL29866656 0.83 PREP (0.39) PREPCHRM2CHRM1CHRM3USP2
SCHEMBL25165581 0.83 PREP (0.39) PREPCHRM2CHRM1CHRM3USP2
SCHEMBL31457937 0.83 NR1H2 (0.40) PREPCHRM2CHRM1CHRM3CTSK
SCHEMBL19978791 0.81 PREP (0.37) PREPCHRM2CHRM1CHRM3USP2
SCHEMBL19972969 0.80 PTPN1 (0.37) PREPCHRM2CHRM1CHRM3HSD17B10
SCHEMBL2980999 0.79 CHRM2 (0.41) PREPCHRM2CHRM1CHRM3USP2
SCHEMBL31375026 0.77 PREP (0.38) PREPCHRM2CHRM1CHRM3USP2
SCHEMBL629586 0.77 ACE (0.47) PREPCHRM2CHRM1CHRM3USP2
SCHEMBL10137609 0.77 PREP (0.38) PREPCHRM2CHRM1CHRM3USP2

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-20170210765-A1 PROCESS FOR PREPARING ALPHA-SILYLAMINE COMPOUNDS FROM ALPHA-SILYLMETHYL AZIDE COMPOUNDS POSTECH ACADEMY-INDUSTRY FOUNDATION (KR) 2017-07-27 US disclosed
WO-2016053017-A1 PROCESS FOR PREPARING ALPHA-SILYLAMINE COMPOUNDS FROM ALPHA-SILYLMETHYL AZIDE COMPOUNDS 포항공과대학교 산학협력단 2016-04-07 WO 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-20170210765-A1 PROCESS FOR PREPARING ALPHA-SILYLAMINE COMPOUNDS FROM ALPHA-SILYLMETHYL AZIDE COMPOUNDS ITGAL, MANBA, ITGA1 PREP 2195/4885CHRM2 2539/4885CHRM1 500/4885

“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.