SCHEMBL5754489

SCHEMBL5754489

NC(=O)N1CC(OCc2ccccc2)C[C@H]1C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
AGTR2 P50052 11/20 0.57
BDKRB2 P30411 2/20 0.50
MMP9 P14780 1/20 0.43
CTSL P07711 1/20 0.43
CTSB P07858 1/20 0.43
CTSK P43235 1/20 0.43
BACE1 P56817 2/20 0.42
S1PR5 Q9H228 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
SCHEMBL9603360 0.89 AGTR2 (0.59) AGTR2BDKRB2MMP9CTSLCTSB
SCHEMBL9033443 0.89 AGTR2 (0.59) AGTR2BDKRB2MMP9CTSLCTSB
SCHEMBL9033440 0.89 AGTR2 (0.59) AGTR2BDKRB2MMP9CTSLCTSB
SCHEMBL3784713 0.89 AGTR2 (0.59) AGTR2BDKRB2MMP9CTSLCTSB
SCHEMBL27224005 0.89 AGTR2 (0.59) AGTR2BDKRB2MMP9CTSLCTSB
SCHEMBL5635251 0.86 AGTR2 (0.57) AGTR2BDKRB2MMP9CTSLCTSB
SCHEMBL5635255 0.86 AGTR2 (0.57) AGTR2BDKRB2MMP9CTSLCTSB
SCHEMBL6515997 0.85 AGTR2 (0.56) AGTR2BDKRB2
SCHEMBL15241314 0.85 AGTR2 (0.56) AGTR2BDKRB2
SCHEMBL29921 0.85 AGTR2 (0.56) AGTR2BDKRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7148242-B2 N-formyl hydroxylamine compounds, compositions and methods of use NOVARTIS AG (CH) 2006-12-12 US disclosed
EP-1401828-B1 N-FORMYL HYDROXYLAMINE COMPOUNDS AS INHIBITORS OF PDF VICURON PHARM INC (US) 2006-04-12 EP disclosed
EP-1401828-A1 N-FORMYL HYDROXYLAMINE COMPOUNDS AS INHIBITORS OF PDF Vicuron Pharmaceuticals, Inc. (US) 2004-03-31 EP disclosed
US-20030045479-A1 Novel N-formyl hydroxylamine compounds, compositions and methods of use VICURON HOLDINGS LLC 2003-03-06 US disclosed
WO-2002102790-A1 N-FORMYL HYDROXYLAMINE COMPOUNDS AS INHIBITORS OF PDF VICURON PHARMACEUTICALS INC. (US) 2002-12-27 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-20030045479-A1 Novel N-formyl hydroxylamine compounds, compositions and methods of use PDF, HNMT, AADAC AGTR2 3606/4885BDKRB2 1770/4885MMP9 2416/4885

“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.