SCHEMBL6407009

SCHEMBL6407009

O=C(O)CNC(=O)N1CCCC1C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACE P12821 10/20 0.60
REN P00797 4/20 0.50
THRB P10828 1/20 0.49
ALOX12 P18054 1/20 0.49
KMT2A Q03164 1/20 0.49
ITGB3 P05106 1/20 0.47
ITGB1 P05556 1/20 0.47
ITGAV P06756 1/20 0.47
ITGA5 P08648 1/20 0.47
ITGA4 P13612 1/20 0.47
LMNA P02545 2/20 0.46
HSD17B10 Q99714 2/20 0.46
CYP2C19 P33261 1/20 0.46
KDM4E B2RXH2 1/20 0.46
F2 P00734 1/20 0.46
LTA4H P09960 1/20 0.46
MAPT P10636 1/20 0.46
PEPD P12955 1/20 0.46
ALOX15 P16050 1/20 0.46
PTGS1 P23219 1/20 0.46

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
SCHEMBL17285637 0.87 ACE (0.51) ACERENTHRBALOX12KMT2A
SCHEMBL9728258 0.83 ACE (0.53) ACERENTHRBALOX12KMT2A
SCHEMBL4728479 0.83 THRB (0.49) ACERENTHRBALOX12KMT2A
SCHEMBL17285592 0.81 ACE (0.48) ACERENTHRBALOX12KMT2A
SCHEMBL6405913 0.79 FKBP1A (0.46) ACEKMT2ALMNAHSD17B10CYP2C19
SCHEMBL4902901 0.79 RAB9A (0.56) ACERENITGB3ITGB1ITGAV
SCHEMBL3103071 0.79 ACE (0.60) ACERENTHRBALOX12KMT2A
SCHEMBL17285634 0.79 ACE (0.46) ACERENTHRBALOX12KMT2A
SCHEMBL2422744 0.78 ACE (0.48) ACERENTHRBALOX12KMT2A
SCHEMBL2422749 0.78 ACE (0.48) ACERENTHRBALOX12KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6852752-B2 Urea compounds, compositions and methods of use and preparation VICURON PHARMACEUTICALS INC. (US) 2005-02-08 US disclosed
US-20020119962-A1 Novel urea compounds, compositions and methods of use and preparation VICURON HOLDINGS LLC 2002-08-29 US disclosed
WO-2001044178-A1 NOVEL UREA COMPOUNDS, COMPOSITIONS AND METHODS OF USE AND PREPARATION VERSICOR, INC. (US) 2001-06-21 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-20020119962-A1 Novel urea compounds, compositions and methods of use and preparation PDF, UROD, HDHD5 ACE 1344/4885REN 1300/4885THRB 3677/4885

“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.