SCHEMBL6932768

SCHEMBL6932768

N#Cc1cccc(C(=O)Nc2ccc(C(CCC(=O)O)=NO)cc2)c1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PLAU P00749 2/20 0.47
F2 P00734 1/20 0.47
PLG P00747 1/20 0.47
KLKB1 P03952 1/20 0.47
PRSS1 P07477 1/20 0.47
NAMPT P43490 1/20 0.47
CCR2 P41597 1/20 0.46
BRAF P15056 3/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
MAPK14 Q16539 2/20 0.45
SLC2A1 P11166 1/20 0.45
IRAK4 Q9NWZ3 1/20 0.45
GRM5 P41594 1/20 0.45
SIRT2 Q8IXJ6 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44

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
SCHEMBL6932764 1.00 PLAU (0.47) PLAUF2PLGKLKB1PRSS1
SCHEMBL6931486 0.87 MLYCD (0.53) PLAUF2PLGKLKB1PRSS1
SCHEMBL6931485 0.87 MLYCD (0.53) PLAUF2PLGKLKB1PRSS1
SCHEMBL6930593 0.86 MAPT (0.53) PLAUF2PLGKLKB1PRSS1
SCHEMBL6929458 0.83 NPC1 (0.57) MEN1KMT2ASMN1; SMN2
SCHEMBL6929457 0.83 NPC1 (0.57) MEN1KMT2ASMN1; SMN2
SCHEMBL6930421 0.82 KMT2A (0.59) MEN1KMT2ASMN1; SMN2
SCHEMBL6930425 0.82 KMT2A (0.59) MEN1KMT2ASMN1; SMN2
SCHEMBL6931415 0.82 KMT2A (0.65) MEN1KMT2ASMN1; SMN2RXFP1
SCHEMBL6931412 0.82 KMT2A (0.65) MEN1KMT2ASMN1; SMN2RXFP1

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
US-6624196-B2 Particularly gelatinase A, collagenase-3, and stromelysin-1 and for the treatment of multiple sclerosis, cardiovascular disorders WARNER-LAMBERT COMPANY 2003-09-23 US claimed
US-6541521-B1 Particularly gelatinase A, collagenase-3, and stromelysin-1 WARNER-LAMBERT COMPANY 2003-04-01 US claimed
US-20020161050-A1 Benzene butyric acids and their derivatives as inhibitors of matrix metalloproteinases WARNER-LAMBERT COMPANY (US) 2002-10-31 US claimed
US-6624196-B2 Particularly gelatinase A, collagenase-3, and stromelysin-1 and for the treatment of multiple sclerosis, cardiovascular disorders WARNER-LAMBERT COMPANY 2003-09-23 US disclosed
US-6541521-B1 Particularly gelatinase A, collagenase-3, and stromelysin-1 WARNER-LAMBERT COMPANY 2003-04-01 US disclosed
US-20020161050-A1 Benzene butyric acids and their derivatives as inhibitors of matrix metalloproteinases WARNER-LAMBERT COMPANY (US) 2002-10-31 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-20020161050-A1 Benzene butyric acids and their derivatives as inhibitors of matrix metalloproteinases MMP1, MMP8, MMP13 PLAU 620/4885F2 2303/4885PLG 165/4885

“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.