SCHEMBL6360232

SCHEMBL6360232

CC(C)(C)OC(=O)c1ccc(Cn2cnc3cnc(C(=O)NCc4cccc(F)c4)cc3c2=O)cc1

nearest known ligand 0.78

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 17/20 0.78
SLC22A8 Q8TCC7 1/20 0.60
GRK2 P25098 1/20 0.48
CNR1 P21554 1/20 0.45
RECQL P46063 1/20 0.45
MAPK10 P53779 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL6363321 0.92 MMP13 (0.77) MMP13SLC22A8GRK2RECQLMAPK10
SCHEMBL6363604 0.91 MMP13 (0.78) MMP13SLC22A8GRK2RECQLMAPK10
SCHEMBL6360332 0.91 MMP13 (0.80) MMP13SLC22A8GRK2RECQLMAPK10
SCHEMBL6440274 0.91 MMP13 (0.64) MMP13SLC22A8GRK2RECQLMAPK10
SCHEMBL6360104 0.90 MMP13 (0.81) MMP13SLC22A8
SCHEMBL6357989 0.88 MMP13 (0.65) MMP13SLC22A8RECQLMAPK10SMN1; SMN2
SCHEMBL6359418 0.88 MMP13 (0.76) MMP13SLC22A8RECQLMAPK10SMN1; SMN2
SCHEMBL6359845 0.88 MMP13 (1.00) MMP13SLC22A8GRK2
SCHEMBL6358491 0.87 MMP13 (0.79) MMP13SLC22A8GRK2
SCHEMBL6363015 0.87 MMP13 (0.77) MMP13SLC22A8RECQLMAPK10SMN1; SMN2

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-20050085447-A1 Pyrido[3,4-d]pyrimidine derivatives as matrix metalloproteinase-13 inhibitors WARNER-LAMBERT COMPANY LLC 2005-04-21 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-20050085447-A1 Pyrido[3,4-d]pyrimidine derivatives as matrix metalloproteinase-13 inhibitors MMP13, MMP9, MMP3 MMP13 1/4885SLC22A8 2982/4885GRK2 2455/4885

“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.