SCHEMBL6196246

SCHEMBL6196246

N#Cc1ccc(C(O)c2ccc3ccc(C#CCc4ccccc4)cc3c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 3/20 0.43
LSS P48449 1/20 0.41
FFAR1 O14842 1/20 0.37
FFAR4 Q5NUL3 1/20 0.37
TOP2A P11388 1/20 0.36
TOP2B Q02880 1/20 0.36
MAOB P27338 3/20 0.35
MAOA P21397 2/20 0.35
F2R P25116 1/20 0.34
ASIC3 Q9UHC3 1/20 0.33
MAPT P10636 1/20 0.33
FNTA P49354 1/20 0.33
FNTB P49356 1/20 0.33
PGGT1B P53609 1/20 0.33
ADRB3 P13945 1/20 0.33
SLC1A3 P43003 1/20 0.33
SLC1A2 P43004 1/20 0.33
CYP19A1 P11511 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
ALOX5 P09917 1/20 0.32

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
SCHEMBL6193294 0.85 MMP13 (0.47) MMP13FFAR1FFAR4
SCHEMBL6192938 0.83 LSS (0.39) MMP13LSSFFAR1FFAR4
SCHEMBL6194613 0.83 FFAR1 (0.40) MMP13FFAR1FFAR4MAOB
SCHEMBL6195243 0.82 CA2 (0.49) MMP13LSS
SCHEMBL6838206 0.81 ALDH1A1 (0.42) FFAR1FFAR4MAPT
SCHEMBL6192924 0.81 MMP13 (0.51) MMP13FFAR1FFAR4MAPTADRB3
SCHEMBL6838409 0.80 ALDH1A1 (0.38) MMP13LSSFFAR1FFAR4MAPT
SCHEMBL7345248 0.79 ASIC3 (0.46) MMP13FFAR1FFAR4MAOBMAOA
SCHEMBL5664054 0.72 LSS (0.55) LSSTOP2ATOP2BMAOBMAOA
SCHEMBL6211732 0.71 MMP13 (0.43) MMP13FFAR1FFAR4

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
EP-1539163-A1 4-HYDROXYQUINOLINE DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS Warner-Lambert Company LLC (US) 2005-06-15 EP disclosed
US-20040043983-A1 Naphthalene derivatives as matrix metalloproteinase inhibitors LI JIE JACK (US) 2004-03-04 US disclosed
WO-2004014377-A1 4-HYDROXYQUINOLINE DERIVATIVES AS MATRIX 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-20040043983-A1 Naphthalene derivatives as matrix metalloproteinase inhibitors MMP9, MMP8, MMP13 MMP13 3/4885LSS 2553/4885FFAR1 2162/4885

“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.