SCHEMBL6702161

SCHEMBL6702161

O=C1NC(=O)C(C(O)c2ccc(C(F)(F)F)cc2)N1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.41
CES1 P23141 2/20 0.41
ADAMTS5 Q9UNA0 1/20 0.39
TOP2A P11388 1/20 0.36
TOP2B Q02880 1/20 0.36
ACP3 P15309 1/20 0.36
HSD11B1 P28845 2/20 0.35
MMP2 P08253 1/20 0.35
MMP8 P22894 1/20 0.35
DDB1 Q16531 1/20 0.35
CRBN Q96SW2 1/20 0.35
PPARG P37231 1/20 0.34
HSD17B2 P37059 1/20 0.34
PDE2A O00408 2/20 0.34
TSHR P16473 1/20 0.33
FFAR1 O14842 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
SCHEMBL6702754 0.83 CES2 (0.45) CES2ACP3HSD11B1HSD17B2
SCHEMBL10620249 0.79 ALDH1A1 (0.41) HSD17B2
SCHEMBL6791191 0.77 MMP2 (0.35) ADAMTS5MMP2MMP8HSD17B2TSHR
SCHEMBL6798684 0.77 HSD17B2 (0.40) ACP3HSD17B2FFAR1
SCHEMBL6798968 0.77 HSD17B2 (0.40) ACP3HSD17B2FFAR1
SCHEMBL6786610 0.77 HSD17B2 (0.40) ACP3HSD17B2FFAR1
SCHEMBL6793693 0.72 LMNA (0.42) MMP2MMP8HSD17B2FFAR1
SCHEMBL6701806 0.72 PRMT5 (0.35) ADAMTS5MMP2
SCHEMBL6793720 0.69 SRD5A2 (0.40)
SCHEMBL6841040 0.69 MEN1 (0.35) HSD17B2

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-20040147573-A1 Metalloproteinase inhibitors ASTRAZENECA AB (SE) 2004-07-29 US disclosed
US-20040116486-A1 Metalloproteinase inhibitors ASTRAZENECA AB (SE) 2004-06-17 US disclosed
EP-1370536-A1 METALLOPROTEINASE INHIBITORS AstraZeneca AB (SE) 2003-12-17 EP disclosed
WO-2002074750-A1 METALLOPROTEINASE INHIBITORS ASTRAZENECA AB (SE) 2002-09-26 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-20040147573-A1 Metalloproteinase inhibitors MMP12, MMP7, MMP10 CES2 485/4885CES1 96/4885ADAMTS5 48/4885

“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.