SCHEMBL6682933

SCHEMBL6682933

CC1=C2CSC(C(=O)NCc3ccc(F)cc3)=CC2C(=O)N(Cc2ccccc2)C1=O

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.44
CNR2 P34972 1/20 0.43
SCD O00767 1/20 0.43
SMN1; SMN2 Q16637 4/20 0.41
MAPT P10636 2/20 0.41
TP53 P04637 2/20 0.41
HTR7 P34969 1/20 0.41
KMT2A Q03164 2/20 0.39
LMNA P02545 2/20 0.39
HPGD P15428 2/20 0.39
ALOX12 P18054 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP2C19 P33261 1/20 0.38
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 1/20 0.38
PRKAA2 P54646 1/20 0.38

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
SCHEMBL6718159 0.84 GPBAR1 (0.39) SMN1; SMN2HTR7KMT2ALMNAL3MBTL1
SCHEMBL6716879 0.84 CNR2 (0.43) TRPA1CNR2SCDSMN1; SMN2MAPT
SCHEMBL6681347 0.83 CNR2 (0.44) TRPA1CNR2SCDSMN1; SMN2MAPT
SCHEMBL7064086 0.82 CNR2 (0.43) TRPA1CNR2SCDSMN1; SMN2MAPT
SCHEMBL6678893 0.71 GPBAR1 (0.39) SMN1; SMN2KMT2ALMNAHPGDL3MBTL1
SCHEMBL20263921 0.66 MAPT (0.47) TRPA1CNR2SCDSMN1; SMN2MAPT
Hydrochloric Acid SCHEMBL20264080 0.65 MAPT (0.46) TRPA1CNR2SCDSMN1; SMN2MAPT
SCHEMBL6476937 0.65 SMN1; SMN2 (0.41) TRPA1CNR2SCDSMN1; SMN2MAPT
SCHEMBL8133573 0.61 CASP3 (0.57) MAPTTP53KMT2ALMNAHPGD
SCHEMBL5957503 0.61 TRPA1 (1.00) TRPA1CNR2MAPTTP53L3MBTL1

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
US-20040034009-A1 1,6-Fused uracil derivatives as matrix metalloproteinase inhibitors ROARK WILLIAM HOWARD (US) 2004-02-19 US disclosed
WO-2004014354-A1 1,6-FUSED URACIL 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-20040034009-A1 1,6-Fused uracil derivatives as matrix metalloproteinase inhibitors MMP9, MMP13, MMP11 TRPA1 4681/4885CNR2 4623/4885SCD 1447/4885

“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.