SCHEMBL6484735

SCHEMBL6484735

CC1=C2SC(C#Cc3ccccc3)=NN2C(=O)C(Cc2ccc(F)c(F)c2)C1=O

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CES2 O00748 13/20 0.35
GRM5 P41594 2/20 0.34
FFAR1 O14842 1/20 0.34
FFAR4 Q5NUL3 1/20 0.34
GRM4 Q14833 2/20 0.31
KDM4E B2RXH2 1/20 0.31
RAB9A P51151 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
P2RX7 Q99572 1/20 0.30

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
SCHEMBL6477114 0.81 FFAR1 (0.34) GRM5FFAR1FFAR4GRM4
SCHEMBL6477346 0.80 CES2 (0.36) CES2GRM4P2RX7
SCHEMBL6476092 0.80 GRM5 (0.36) CES2GRM5FFAR1FFAR4GRM4
SCHEMBL6476099 0.76 CES2 (0.34) CES2GRM5FFAR1FFAR4KDM4E
SCHEMBL6477108 0.76 PTGER4 (0.39) CES2P2RX7
SCHEMBL6818421 0.75 CES2 (0.36) CES2GRM5FFAR1FFAR4KDM4E
SCHEMBL6818731 0.74
SCHEMBL6486218 0.74 FFAR1 (0.34) GRM5FFAR1FFAR4GRM4
SCHEMBL6476008 0.73 FFAR1 (0.34) GRM5FFAR1FFAR4GRM4
SCHEMBL6818734 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6897223-B2 Pyridine fused bicyclic metalloproteinase inhibitors WARNER-LAMBERT COMPANY (US) 2005-05-24 US disclosed
US-20040039012-A1 Pyridine fused bicyclic metalloproteinase inhibitors WILSON MICHAEL WILLIAM (US) 2004-02-26 US disclosed
WO-2004014908-A1 HETEROBICYLCIC 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 (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-20040039012-A1 Pyridine fused bicyclic metalloproteinase inhibitors MMP9, MMP1, MMP2 CES2 2239/4885GRM5 2400/4885FFAR1 1620/4885

“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.