SCHEMBL6489803

SCHEMBL6489803

CC(OC(=O)N1CCc2c(c(=O)n(Cc3ccccc3)c(=O)n2C)C1)c1cc2ccccc2[nH]1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CLPP Q16740 1/20 0.40
KDR P35968 1/20 0.38
TP53 P04637 4/20 0.38
LMNA P02545 1/20 0.38
MCHR1 Q99705 2/20 0.36
LGMN Q99538 1/20 0.36
MAPT P10636 5/20 0.35
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
HDAC1 Q13547 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34

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
SCHEMBL6488519 0.84 KDR (0.46) CLPPKDRTP53LMNAMAPT
SCHEMBL6487433 0.79 KDR (0.43) CLPPKDR
SCHEMBL6528676 0.77 HDAC1 (0.54) CLPPTP53LMNAALDH1A1HDAC1
SCHEMBL6489965 0.76 KDR (0.38) KDRTP53LMNAALDH1A1
SCHEMBL6487201 0.75 KDR (0.37) KDRALDH1A1HDAC6
SCHEMBL6487929 0.75 HDAC1 (0.42) CLPPTP53LMNAMAPTALDH1A1
SCHEMBL6489798 0.75 HDAC1 (0.47) CLPPTP53LMNAMAPTALDH1A1
SCHEMBL6495693 0.75 CLPP (0.46) CLPPTP53LMNAMAPTALDH1A1
SCHEMBL6499579 0.74 ALDH1A1 (0.47) CLPPTP53LMNAMAPTALDH1A1
SCHEMBL6500183 0.74 TP53 (0.44) CLPPTP53LMNAMAPTALDH1A1

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-6869958-B2 Fused tetrahydropyridine derivatives as matrix metalloproteinase inhibitors WARNER-LAMBERT COMPANY (US) 2005-03-22 US disclosed
US-20040038960-A1 Fused tetrahydropyridine derivatives as matrix metalloproteinase inhibitors LI JIE JACK (US) 2004-02-26 US disclosed
WO-2004014909-A1 FUSED TETRAHYDROPYRIDINE 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-20040038960-A1 Fused tetrahydropyridine derivatives as matrix metalloproteinase inhibitors MMP9, MMP3, MMP13 CLPP 3602/4885KDR 3681/4885TP53 3469/4885

“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.