SCHEMBL6208610

SCHEMBL6208610

N#Cc1ccc(-n2ncc3cc(Oc4ccc([N+](=O)[O-])cn4)ccc32)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.49
GAA P10253 2/20 0.49
PGR P06401 1/20 0.47
HSPB1 P04792 2/20 0.46
MAPT P10636 9/20 0.45
ALDH1A1 P00352 4/20 0.45
HTT P42858 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
LMNA P02545 2/20 0.45
MAPK1 P28482 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
NPSR1 Q6W5P4 1/20 0.43
CHEK2 O96017 1/20 0.40
HPGD P15428 3/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
NPC1 O15118 1/20 0.37
PKM P14618 1/20 0.37
CYP11B2 P19099 1/20 0.37
CYP19A1 P11511 1/20 0.37

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
SCHEMBL6208447 0.87 HSPB1 (0.65) L3MBTL1GAAPGRHSPB1MAPT
SCHEMBL6210535 0.83 PGR (0.50) PGRALDH1A1MEN1KMT2ACYP11B2
SCHEMBL6208856 0.81 CYP11B2 (0.49) L3MBTL1GAAHSPB1MAPTALDH1A1
SCHEMBL6211088 0.77 HSPB1 (0.55) L3MBTL1GAAHSPB1MAPTALDH1A1
SCHEMBL6183317 0.75 PGR (0.55) PGRMAPTALDH1A1HTTSMN1; SMN2
SCHEMBL6209292 0.74 PGR (0.41) PGRKDM4E
SCHEMBL6207960 0.74 MMP13 (0.64) PGR
SCHEMBL6208641 0.71 MMP13 (0.44) PGRKDM4E
SCHEMBL1982917 0.71 L3MBTL1 (0.58) L3MBTL1GAAHSPB1MAPTALDH1A1
SCHEMBL29437991 0.71 L3MBTL1 (0.58) L3MBTL1GAAHSPB1MAPTALDH1A1

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
EP-1501833-B1 N-SUBSTITUTED-HETEROARYLOXY-ARYL-SPIRO-PYRIMIDINE-2,4,6-TRIONE METALLOPROTEINASE INHIBITORS PFIZER PROD INC (US) 2005-11-02 EP disclosed
US-6900201-B2 N-substituted-heteroaryloxy-aryl-spiro-pyrimidine-2,4,6-trione metalloproteinase inhibitors PFIZER INC. (US) 2005-05-31 US disclosed
EP-1501833-A1 N-SUBSTITUTED-HETEROARYLOXY-ARYL-SPIRO-PYRIMIDINE-2,4,6-TRIONE METALLOPROTEINASE INHIBITORS Pfizer Products Inc. (US) 2005-02-02 EP disclosed
US-20040010141-A1 N-substituted-heteroaryloxy-aryl-spiro-pyrimidine-2,4,6-trione metalloproteinase inhibitors PFIZER INC. 2004-01-15 US disclosed
WO-2003091258-A1 N-SUBSTITUTED-HETEROARYLOXY-ARYL-SPIRO-PYRIMIDINE-2,4,6-TRIONE METALLOPROTEINASE INHIBITORS PFIZER PRODUCTS INC. (US) 2003-11-06 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-20040010141-A1 N-substituted-heteroaryloxy-aryl-spiro-pyrimidine-2,4,6-trione metalloproteinase inhibitors MMP9, MMP8, MMP2 L3MBTL1 4271/4885GAA 333/4885PGR 415/4885

“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.