SCHEMBL6679307

SCHEMBL6679307

Cc1c2n(c(=O)n(Cc3ccc(F)c(F)c3)c1=O)C=C(C(=O)NCc1ccc(F)cc1)NC2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 4/20 0.43
PDPK1 O15530 4/20 0.38
HTR7 P34969 1/20 0.37
CACNA1G O43497 1/20 0.37
CACNA1H O95180 1/20 0.37
CACNA1I Q9P0X4 1/20 0.37
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37
S1PR3 Q99500 2/20 0.36
MAPT P10636 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
ALDH1A1 P00352 2/20 0.36
LMNA P02545 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
GAA P10253 1/20 0.36
TSHR P16473 1/20 0.36
HPGD P15428 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
TP53 P04637 1/20 0.35

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
SCHEMBL6683316 0.86 TRPA1 (0.44) TRPA1CNR1CNR2MAPTMEN1
SCHEMBL6680959 0.85 ALDH1A1 (0.38) ALDH1A1L3MBTL1TSHRPOLB
SCHEMBL6683536 0.82 TRPA1 (0.45) TRPA1HTR7CACNA1GCACNA1HCACNA1I
SCHEMBL6685075 0.82 TRPA1 (0.43) TRPA1HTR7CACNA1GCACNA1HCACNA1I
SCHEMBL6678339 0.76 MAPT (0.51) TRPA1MAPTMEN1KMT2AALDH1A1
SCHEMBL6682735 0.71 KDM4E (0.38) MAPTALDH1A1LMNAL3MBTL1GAA
SCHEMBL6684992 0.71 TRPA1 (0.39) TRPA1MEN1KMT2ALMNATSHR
SCHEMBL6681574 0.70 ALDH1A1 (0.36) CNR1CNR2MAPTMEN1KMT2A
SCHEMBL6679240 0.70 TP53 (0.36) TRPA1MAPTALDH1A1LMNAL3MBTL1
SCHEMBL6679462 0.70 ALDH1A1 (0.36) TRPA1ALDH1A1L3MBTL1TSHRTP53

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
WO-2004014354-A1 1,6-FUSED URACIL DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2004-02-19 WO claimed
US-20040034009-A1 1,6-Fused uracil derivatives as matrix metalloproteinase inhibitors ROARK WILLIAM HOWARD (US) 2004-02-19 US claimed
WO-2004014354-A1 1,6-FUSED URACIL DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2004-02-19 WO disclosed
US-20040034009-A1 1,6-Fused uracil derivatives as matrix metalloproteinase inhibitors ROARK WILLIAM HOWARD (US) 2004-02-19 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-20040034009-A1 1,6-Fused uracil derivatives as matrix metalloproteinase inhibitors MMP9, MMP13, MMP11 TRPA1 4681/4885PDPK1 2509/4885HTR7 4354/4885

“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.