SCHEMBL5837339

SCHEMBL5837339

Oc1ccc(Oc2ccc(-c3nc(-c4ccccc4)co3)cc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP3 O14638 3/20 0.65
ENPP1 P22413 3/20 0.65
HSD17B1 P14061 1/20 0.62
HSD17B2 P37059 1/20 0.62
MMP13 P45452 1/20 0.49
LTA4H P09960 3/20 0.49
NR1H2 P55055 1/20 0.49
BAX Q07812 1/20 0.49
SMO Q99835 2/20 0.47
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
NTSR1 P30989 1/20 0.45
USP7 Q93009 1/20 0.45
TLR8 Q9NR97 1/20 0.44
MCL1 Q07820 1/20 0.42
ESR1 P03372 1/20 0.41
ESR2 Q92731 1/20 0.41
ALDH1A1 P00352 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41

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
SCHEMBL5836271 0.85 ENPP3 (0.89) ENPP3ENPP1HSD17B1HSD17B2MMP13
SCHEMBL5836277 0.83 MMP13 (0.52) ENPP3ENPP1HSD17B1HSD17B2MMP13
SCHEMBL5836726 0.82 MMP13 (0.55) ENPP3ENPP1HSD17B1HSD17B2MMP13
SCHEMBL3271684 0.82 ENPP3 (0.72) ENPP3ENPP1HSD17B1HSD17B2MMP13
SCHEMBL11566150 0.82 ENPP3 (0.72) ENPP3ENPP1HSD17B1HSD17B2MMP13
SCHEMBL5836684 0.81 MMP13 (0.58) ENPP3ENPP1HSD17B1HSD17B2MMP13
SCHEMBL5664564 0.81 ENPP3 (0.75) ENPP3ENPP1HSD17B1HSD17B2MMP13
Benzene SCHEMBL16781371 0.80 ENPP3 (0.69) ENPP3ENPP1HSD17B1HSD17B2SMO
SCHEMBL278182 0.80 ENPP3 (0.69) ENPP3ENPP1HSD17B1HSD17B2SMO
SCHEMBL5836215 0.79 MMP13 (0.57) ENPP3ENPP1HSD17B1HSD17B2MMP13

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-7119201-B2 Triaryl-oxy-aryloxy-pyrimidine-2,4,6-trione metalloproteinase inhibitors PFIZER INC (US) 2006-10-10 US disclosed
EP-1501515-B1 TRIARYL-OXY-ARYLOXY-PYRIMIDINE-2,4,6-TRIONE METALLOPROTEINASE INHIBITORS PFIZER PROD INC (US) 2005-11-02 EP disclosed
US-20040006057-A1 Triaryl-oxy-aryloxy-pyrimidine-2,4,6-trione metalloproteinase inhibitors PFIZER PRODUCTS INC. 2004-01-08 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-20040006057-A1 Triaryl-oxy-aryloxy-pyrimidine-2,4,6-trione metalloproteinase inhibitors MMP8, MMP9, MMP1 ENPP3 378/4885ENPP1 130/4885HSD17B1 360/4885

“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.