SCHEMBL7043312

SCHEMBL7043312

CC(CCNC(=O)OCc1ccccc1)CC(=O)NCC(=O)c1nc2cc(-c3ccccc3)ccc2o1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 3/20 0.40
MMP9 P14780 3/20 0.40
MMP3 P08254 2/20 0.40
MMP14 P50281 2/20 0.40
MMP1 P03956 1/20 0.40
MMP7 P09237 1/20 0.40
ATM Q13315 2/20 0.37
SLC1A3 P43003 1/20 0.37
SLC1A1 P43005 1/20 0.37
LMNA P02545 2/20 0.37
GAA P10253 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
HTT P42858 1/20 0.37
KMT2A Q03164 1/20 0.37
PTGER4 P35408 3/20 0.37
DAGLA Q9Y4D2 1/20 0.37

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
SCHEMBL7046281 0.90 FAAH (0.41) ATMSLC1A3SLC1A1LMNAL3MBTL1
SCHEMBL7045316 0.85 MAPT (0.40) MMP2MMP9MMP3MMP14MMP1
SCHEMBL7049752 0.78 KMT2A (0.43) MMP2MMP9ATMSLC1A3SLC1A1
SCHEMBL7046968 0.77 ELANE (0.44) ATMSLC1A3SLC1A1LMNAL3MBTL1
SCHEMBL7043308 0.77 DAGLA (0.37) GAAL3MBTL1DAGLAMAPTLIPG
SCHEMBL6183151 0.74 SLC1A3 (0.52) SLC1A3SLC1A1LMNAL3MBTL1HTT
SCHEMBL7049084 0.74 MAPT (0.43) ATMSLC1A3SLC1A1LMNAL3MBTL1
SCHEMBL7045499 0.72 ELANE (0.43) ATMSLC1A3SLC1A1MAPT
SCHEMBL6063445 0.71 PTGER4 (0.47) SLC1A3SLC1A1LMNAL3MBTL1MEN1
SCHEMBL7046917 0.71 HDAC1 (0.40) MMP2MMP9MMP3MMP14MMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030232864-A1 Novel Compounds and compositions as protease inhibitors AXYS PHARMACEUTICALS, INC. (US) 2003-12-18 US disclosed
US-6576630-B1 Alkanoyl substituted benzooxazoles or naphthooxazoles AXYS PHARMACEUTICALS, INC. 2003-06-10 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-20030232864-A1 Novel Compounds and compositions as protease inhibitors SERPINB1, CTRL, CTSZ MMP2 91/4885MMP9 94/4885MMP3 72/4885

“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.