SCHEMBL7064086

SCHEMBL7064086

CC1=C2CS(=O)(=O)C(C(=O)NCc3ccc(F)cc3)=CC2C(=O)N(Cc2ccccc2)C1=O

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.43
SCD O00767 1/20 0.43
TRPA1 O75762 1/20 0.42
NPC1 O15118 1/20 0.41
ALDH1A1 P00352 3/20 0.40
MAPT P10636 3/20 0.39
KMT2A Q03164 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
LIPG Q9Y5X9 1/20 0.39
S1PR3 Q99500 1/20 0.39
TP53 P04637 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP2C19 P33261 1/20 0.38
KDM4E B2RXH2 1/20 0.38
LMNA P02545 1/20 0.38
HPGD P15428 1/20 0.38
SMN1; SMN2 Q16637 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
SCHEMBL6681347 0.83 CNR2 (0.44) CNR2SCDTRPA1ALDH1A1MAPT
SCHEMBL6682933 0.82 TRPA1 (0.44) CNR2SCDTRPA1ALDH1A1MAPT
SCHEMBL6716879 0.82 CNR2 (0.43) CNR2SCDTRPA1ALDH1A1MAPT
SCHEMBL6718159 0.70 GPBAR1 (0.39) ALDH1A1KMT2AL3MBTL1CYP1A2CYP2C19
SCHEMBL6678893 0.70 GPBAR1 (0.39) ALDH1A1KMT2AL3MBTL1CYP1A2KDM4E
SCHEMBL20264180 0.67 MAPT (0.43) CNR2TRPA1MAPTKMT2AL3MBTL1
Hydrochloric Acid SCHEMBL20264086 0.66 MAPT (0.43) CNR2TRPA1MAPTKMT2AL3MBTL1
SCHEMBL8133573 0.61 CASP3 (0.57) ALDH1A1MAPTKMT2AL3MBTL1TP53
SCHEMBL5538731 0.61 KCNH2 (0.46) CNR2SCDTRPA1ALDH1A1KMT2A
SCHEMBL5230740 0.61 HDAC6 (0.72) NPC1ALDH1A1KMT2AL3MBTL1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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 CNR2 4623/4885SCD 1447/4885TRPA1 4681/4885

“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.