SCHEMBL4933797

SCHEMBL4933797

NC(=O)c1c(NC(=O)C(=O)O)cccc1OCCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 12/20 0.49
GPR35 Q9HC97 1/20 0.40
PTGES O14684 1/20 0.39
ALOX5 P09917 1/20 0.39
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39
BRD4 O60885 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL11618860 0.86 MEN1 (0.49) SIRT2GPR35KMT2A
SCHEMBL11621475 0.86 GPR35 (0.43) GPR35
SCHEMBL11537144 0.85 MAPT (0.50) GPR35KMT2A
SCHEMBL11540031 0.84 KMT2A (0.47) GPR35KMT2A
SCHEMBL5263345 0.82 SIRT2 (0.49) SIRT2PTGESALOX5CNR1CNR2
SCHEMBL11539257 0.82 LMNA (0.48) GPR35KMT2A
SCHEMBL11445154 0.81 ALDH1A1 (0.49)
SCHEMBL12095380 0.79 SIRT2 (0.46) SIRT2PTGESALOX5CNR1CNR2
SCHEMBL4933653 0.79 NPC1 (0.49) SIRT2PTGESALOX5CNR1CNR2
SCHEMBL10425907 0.78 BRD4 (0.54) SIRT2BRD4KMT2A

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-9475822-B2 Substituted 2- amidoquinazol-4-ones as matrix metalloproteinase-13 inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-10-25 US disclosed
US-9212149-B2 Substituted 2-amidoquinazol-4-ones as matrix metalloproteinase-13 inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-12-15 US disclosed
US-20150329556-A1 SUBSTITUTED 2- AMIDOQUINAZOL-4-ONES AS MATRIX METALLOPROTEINASE-13 INHIBITORS TAKEDA PHARMACEUTICAL (JP) 2015-11-19 US disclosed
US-20080027050-A1 Heterocyclic Amide Compound and Use Thereof as an Mmp-13 Inhibitor(Amended Ex Officio) TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-01-31 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 (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-20150329556-A1 SUBSTITUTED 2- AMIDOQUINAZOL-4-ONES AS MATRIX METALLOPROTEINASE-13 INHIBITORS MMP13, MMP14, MMP25 SIRT2 364/4885GPR35 2052/4885PTGES 1274/4885
US-20080027050-A1 Heterocyclic Amide Compound and Use Thereof as an Mmp-13 Inhibitor(Amended Ex Officio) MMP13, HDAC11, HDAC1 SIRT2 163/4885GPR35 1945/4885PTGES 569/4885

“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.