SCHEMBL6202859

SCHEMBL6202859

O=C1NC(=O)C2(CCCN2c2ccc(Oc3ccc(-c4nc(-c5ccccn5)no4)cc3)nc2)C(=O)N1

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 15/20 0.64
PKM P14618 5/20 0.44
RAB9A P51151 4/20 0.44
NPC1 O15118 3/20 0.44
HSP90AA1 P07900 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
TP53 P04637 4/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
MAPT P10636 2/20 0.43
KMT2A Q03164 2/20 0.43
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
KLF5 Q13887 1/20 0.41
HSD17B10 Q99714 1/20 0.41
MEN1 O00255 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
SCHEMBL6202137 0.94 MMP13 (0.62) MMP13
SCHEMBL6203947 0.91 MMP13 (0.61) MMP13PKMRAB9ANPC1TP53
SCHEMBL6202602 0.90 MMP13 (0.67) MMP13
SCHEMBL6204066 0.90 MMP13 (0.67) MMP13
SCHEMBL6204746 0.88 MMP13 (0.66) MMP13RAB9ANPC1
SCHEMBL6203792 0.88 MMP13 (0.66) MMP13RAB9ANPC1
SCHEMBL6203866 0.87 MMP13 (0.63) MMP13PKMRAB9ANPC1TP53
SCHEMBL6203963 0.87 MMP13 (0.63) MMP13
SCHEMBL6203817 0.87 MMP13 (0.78) MMP13
SCHEMBL6202835 0.87 MMP13 (0.64) MMP13

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
EP-1501834-B1 TRIARYL-OXY-ARYL-SPIRO-PYRIMIDINE-2, 4, 6-TRIONE METALLOPROTEINASE INHIBITORS PFIZER PROD INC (US) 2005-09-07 EP disclosed
US-6916807-B2 Triaryl-oxy-aryl-spiro-pyrimidine-2,4,6-trione metalloproteinase inhibitors PFIZER INC. (US) 2005-07-12 US disclosed
US-20030225056-A1 Triaryl-oxy-aryl-spiro-pyrimidine-2,4,6-trione metalloproteinase inhibitors PFIZER INC. 2003-12-04 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-20030225056-A1 Triaryl-oxy-aryl-spiro-pyrimidine-2,4,6-trione metalloproteinase inhibitors MMP9, TIMP3, MMP8 MMP13 15/4885PKM 3052/4885RAB9A 3823/4885

“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.