SCHEMBL6288756

SCHEMBL6288756

CC(c1ccc(C(=O)O)cc1)N1Cc2oc(C(=O)NCc3ccccc3)cc2NC1=O

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.42
POLB P06746 2/20 0.42
ALDH1A1 P00352 2/20 0.40
PTGER4 P35408 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ATM Q13315 1/20 0.40
MAPT P10636 1/20 0.40
TP53 P04637 1/20 0.39
HPGD P15428 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MAPK1 P28482 5/20 0.38
NR1H4 Q96RI1 3/20 0.38
EPHX2 P34913 2/20 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
SCHEMBL6289361 0.80 MAPK1 (0.38) MAPK1
SCHEMBL6706802 0.74 NPC1 (0.51) LMNAPOLBALDH1A1MEN1KMT2A
SCHEMBL6706893 0.69 MAPK1 (0.45) MAPK1
SCHEMBL6694969 0.69 MAPK1 (0.38) MAPK1
SCHEMBL6705942 0.68 ALDH1A1 (0.48) ALDH1A1PTGER4MAPTSMN1; SMN2NR1H4
SCHEMBL6288755 0.68 TP53 (0.45) LMNAPOLBALDH1A1PTGER4MAPT
SCHEMBL6292189 0.65 POLB (0.46) LMNAPOLBALDH1A1PTGER4TP53
SCHEMBL4747957 0.64 NR1H4 (0.81) LMNAPOLBKMT2AHPGDMAPK1
SCHEMBL13460269 0.64 LMNA (0.62) LMNAPOLBALDH1A1MEN1KMT2A
SCHEMBL104431 0.64 RAB9A (0.75) LMNAPOLBALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004014916-A1 PYRIMIDINE FUSED BICYCLIC METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2004-02-19 WO claimed
US-6949651-B2 Fused bicyclic metalloproteinase inhibitors WARNER-LAMBERT COMPANY (US) 2005-09-27 US disclosed
US-20040038994-A1 Pyrimidine fused bicyclic metalloproteinase inhibitors WILSON MICHAEL WILLIAM (US) 2004-02-26 US disclosed
US-20040034054-A1 Fused bicyclic metalloproteinase inhibitors LINCOLN FOODSERVICE PRODUCTS INC. 2004-02-19 US disclosed
WO-2004014375-A2 FUSED BICYCLIC METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2004-02-19 WO disclosed
WO-2004014916-A1 PYRIMIDINE FUSED BICYCLIC METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2004-02-19 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-20040034054-A1 Fused bicyclic metalloproteinase inhibitors MMP9, MMP1, MMP2 LMNA 1817/4885POLB 2737/4885ALDH1A1 337/4885
US-20040038994-A1 Pyrimidine fused bicyclic metalloproteinase inhibitors MMP9, MMP1, MMP2 LMNA 2847/4885POLB 678/4885ALDH1A1 221/4885

“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.