SCHEMBL6703992

SCHEMBL6703992

O=C(NCc1ccccc1)c1nc2c(=O)n(Cc3ccc(F)cc3)cnc2o1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.52
MMP13 P45452 4/20 0.49
LMNA P02545 5/20 0.48
ALDH1A1 P00352 4/20 0.48
KDM4E B2RXH2 3/20 0.48
HPGD P15428 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
POLB P06746 1/20 0.46
CTDSP1 Q9GZU7 1/20 0.46
PIK3CD O00329 1/20 0.44
KMT2A Q03164 2/20 0.44
IDO1 P14902 1/20 0.44
TP53 P04637 1/20 0.43

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
SCHEMBL6814487 0.95 MMP13 (0.56) CNR2MMP13LMNAALDH1A1KDM4E
SCHEMBL6700076 0.90 MMP13 (0.57) MMP13PIK3CD
SCHEMBL6703316 0.84 CNR2 (0.52) CNR2MMP13LMNAALDH1A1KDM4E
SCHEMBL6698574 0.84 LMNA (0.48) MMP13LMNAALDH1A1KDM4EHPGD
SCHEMBL6703507 0.81 MMP13 (0.56) CNR2MMP13LMNAALDH1A1KDM4E
SCHEMBL6698919 0.79 CNR2 (0.53) CNR2MMP13LMNAALDH1A1KDM4E
SCHEMBL6702032 0.71 MMP13 (0.66) MMP13
SCHEMBL6704257 0.71 MMP13 (0.57) MMP13POLBCTDSP1KMT2A
SCHEMBL6705173 0.70 MMP13 (0.52) MMP13LMNAALDH1A1KDM4EHPGD
SCHEMBL6701275 0.70 IDO1 (0.48) CNR2MMP13HPGDPOLBIDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040038994-A1 Pyrimidine fused bicyclic metalloproteinase inhibitors WILSON MICHAEL WILLIAM (US) 2004-02-26 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-20040038994-A1 Pyrimidine fused bicyclic metalloproteinase inhibitors MMP9, MMP1, MMP2 CNR2 3386/4885MMP13 13/4885LMNA 2847/4885

“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.