SCHEMBL7033633

SCHEMBL7033633

Cn1c(=O)n(Cc2ccccc2)c(=O)c2sc(C(=O)NCc3ccccc3)cc21

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 10/20 0.57
SMN1; SMN2 Q16637 2/20 0.53
RXFP1 Q9HBX9 2/20 0.50
TP53 P04637 2/20 0.47
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 1/20 0.46
HSD17B10 Q99714 1/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
POLB P06746 1/20 0.46
ACKR3 P25106 1/20 0.46

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
SCHEMBL6703433 0.94 TRPA1 (0.61) TRPA1SMN1; SMN2RXFP1TP53ALDH1A1
SCHEMBL7033357 0.85 SMN1; SMN2 (0.54) TRPA1SMN1; SMN2TP53KDM4EALDH1A1
SCHEMBL6245168 0.82 TRPA1 (0.62) TRPA1SMN1; SMN2RXFP1KDM4EALDH1A1
SCHEMBL7032058 0.81 MMP13 (0.53) SMN1; SMN2KDM4EALDH1A1HSD17B10MEN1
SCHEMBL7034213 0.80 SMN1; SMN2 (0.50) SMN1; SMN2RXFP1TP53KDM4EALDH1A1
SCHEMBL7035476 0.79 MAPT (0.53) TRPA1SMN1; SMN2TP53KDM4EALDH1A1
SCHEMBL6731246 0.78 TRPA1 (0.67) TRPA1SMN1; SMN2RXFP1TP53KDM4E
SCHEMBL6257817 0.78 TRPA1 (0.66) TRPA1SMN1; SMN2RXFP1TP53MEN1
SCHEMBL6517292 0.78 MAPT (0.59) SMN1; SMN2TP53KDM4EALDH1A1
SCHEMBL6254839 0.77 TRPA1 (0.56) TRPA1SMN1; SMN2RXFP1KDM4EALDH1A1

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-1370562-A1 THIENO[2,3-D]PYRIMIDINDIONE DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS Warner-Lambert Company LLC (US) 2003-12-17 EP disclosed
US-20030004172-A1 Fused pyrimidinone matrix metalloproteinase inhibitors HARTER WILLIAM GLEN (US) 2003-01-02 US disclosed
WO-2002064598-A1 THIENO'2,3-D PYRIMIDINDIONE DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2002-08-22 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-20030004172-A1 Fused pyrimidinone matrix metalloproteinase inhibitors MMP13, MMP3, MMP25 TRPA1 3888/4885SMN1; SMN2 2160/4885RXFP1 173/4885

“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.