SCHEMBL6792382

SCHEMBL6792382

COc1cccc(-c2ccc(C(O)C3(C)NC(=O)NC3=O)cc2)c1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PGR P06401 2/20 0.48
FFAR1 O14842 1/20 0.44
BRD4 O60885 1/20 0.43
HDAC4 P56524 2/20 0.43
HDAC8 Q9BY41 2/20 0.43
CHEK1 O14757 1/20 0.42
ALKBH3 Q96Q83 1/20 0.41
GAA P10253 1/20 0.39
HDAC2 Q92769 1/20 0.39
LMNA P02545 1/20 0.39
XDH P47989 1/20 0.39
DHODH Q02127 1/20 0.39
MAOB P27338 1/20 0.39
NCOA1 Q15788 1/20 0.38
NCOA3 Q9Y6Q9 1/20 0.38
ABL1 P00519 1/20 0.38
ABCB1 P08183 1/20 0.38
BCR P11274 1/20 0.38

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
SCHEMBL6793983 0.87 MMP2 (0.45) FFAR1HDAC4HDAC8HDAC2LMNA
SCHEMBL6786669 0.87 MAPT (0.41) PGRGAALMNAMAOB
SCHEMBL8339982 0.84 PGR (0.41) PGRDHODH
SCHEMBL6793095 0.84 DHODH (0.47) FFAR1HDAC4DHODH
SCHEMBL6789361 0.83 MMP2 (0.41)
SCHEMBL6791153 0.83 MMP2 (0.41)
SCHEMBL6791227 0.83 MMP2 (0.41)
SCHEMBL6835790 0.83 FFAR1 (0.41) PGRFFAR1DHODH
SCHEMBL6792441 0.83 TDP2 (0.40) BRD4DHODH
SCHEMBL6792396 0.81 PTGER3 (0.46) HDAC4HDAC8HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040147573-A1 Metalloproteinase inhibitors ASTRAZENECA AB (SE) 2004-07-29 US disclosed
US-20040110809-A1 Metalloproteinase inhibitors ASTRAZENECA AB (SE) 2004-06-10 US disclosed
EP-1370538-A1 METALLOPROTEINASE INHIBITORS AstraZeneca AB (SE) 2003-12-17 EP disclosed
WO-2002074752-A1 METALLOPROTEINASE INHIBITORS ASTRAZENECA AB (SE) 2002-09-26 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 (2 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-20040110809-A1 Metalloproteinase inhibitors MMP9, MMP2, MMP3 PGR 746/4885FFAR1 3653/4885BRD4 1009/4885
US-20040147573-A1 Metalloproteinase inhibitors MMP12, MMP7, MMP10 PGR 860/4885FFAR1 3703/4885BRD4 1467/4885

“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.