SCHEMBL200833

SCHEMBL200833

CC(C)(C)OC(=O)N1CCS[C@@H]1C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ACE P12821 1/20 0.48
HSD17B10 Q99714 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.38
USP2 O75604 1/20 0.38
PREP P48147 1/20 0.37
RIPK1 Q13546 1/20 0.37
CHRM2 P08172 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36
HPGD P15428 1/20 0.36
GPR119 Q8TDV5 1/20 0.35

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
SCHEMBL200834 1.00 ACE (0.48) ACEHSD17B10SMN1; SMN2USP2PREP
SCHEMBL201910 1.00 ACE (0.48) ACEHSD17B10SMN1; SMN2USP2PREP
SCHEMBL17031886 0.87 USP2 (0.38) ACEHSD17B10SMN1; SMN2USP2PREP
SCHEMBL16790938 0.87 USP2 (0.38) ACEHSD17B10SMN1; SMN2USP2PREP
SCHEMBL13005067 0.85 USP2 (0.37) ACEHSD17B10SMN1; SMN2USP2PREP
SCHEMBL201146 0.84 NR1H2 (0.37) HSD17B10SMN1; SMN2USP2CHRM2CHRM1
SCHEMBL201569 0.84 NR1H2 (0.37) HSD17B10SMN1; SMN2USP2CHRM2CHRM1
SCHEMBL22511349 0.84 HSD17B10 (0.44) HSD17B10SMN1; SMN2USP2PREPCHRM2
SCHEMBL201144 0.84 NR1H2 (0.37) HSD17B10SMN1; SMN2USP2CHRM2CHRM1
SCHEMBL14209871 0.79 USP2 (0.40) HSD17B10SMN1; SMN2USP2PREPRIPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8088804-B2 N-hydroxyamide derivatives possessing antibacterial activity PFIZER INC. (US) 2012-01-03 US disclosed
EP-2338878-A2 N-hydroxyamide derivatives possessing antibacterial activity Vicuron Pharmaceuticals, Inc. (US) 2011-06-29 EP disclosed
US-20100022605-A1 N-HYDROXYAMIDE DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY VICURON PHARMACEUTICALS INC. 2010-01-28 US disclosed
EP-1963262-A2 N-HYDROXYAMIDE DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY Vicuron Pharmaceuticals, Inc. (US) 2008-09-03 EP disclosed
WO-2007069020-A2 N-HYDROXYAMIDE DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY VICURON PHARMACEUTICALS INC. (US) 2007-06-21 WO disclosed
US-5250517-A Hypotensive and cardiotonic agents; cardiac insufficiency HOFFMANN-LA ROCHE INC. (US) 1993-10-05 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-20100022605-A1 N-HYDROXYAMIDE DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY NAAA, HDHD5, HACL2 ACE 370/4885HSD17B10 111/4885SMN1; SMN2 3691/4885

“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.