SCHEMBL6809063

SCHEMBL6809063

CS(=O)(=O)N1CCC(c2ccc(F)cc2)CC1.O=C(CCc1ccccc1)CS(=O)(=O)N1CCC(c2ccccc2F)CC1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 2/20 0.43
POLB P06746 2/20 0.43
RORC P51449 1/20 0.41
TSHR P16473 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
USP5 P45974 1/20 0.38
CYP2C19 P33261 1/20 0.38
ALDH1A1 P00352 3/20 0.37
DRD2 P14416 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
NPY5R Q15761 1/20 0.37
GPR183 P32249 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CHRM4 P08173 2/20 0.36
KDM4E B2RXH2 1/20 0.36

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
SCHEMBL940376 0.89 CYP2C19 (0.43) MMP3POLBCYP2C19ALDH1A1KMT2A
SCHEMBL6808427 0.77 MMP3 (0.41) MMP3USP5DRD2
SCHEMBL942368 0.75 MMP3 (0.46) MMP3SMN1; SMN2USP5ALDH1A1DRD2
SCHEMBL942568 0.74 DRD4 (0.45) MMP3TSHRSMN1; SMN2DRD2CHRM4
SCHEMBL942270 0.72 DPP4 (0.49) RORCTSHRSMN1; SMN2USP5ALDH1A1
SCHEMBL940834 0.71 MMP3 (0.44) MMP3SMN1; SMN2USP5ALDH1A1DRD2
SCHEMBL12911295 0.71 MMP3 (0.52) MMP3SMN1; SMN2USP5CYP2C19ALDH1A1
SCHEMBL9320214 0.67 NPY5R (0.58) POLBTSHRSMN1; SMN2USP5ALDH1A1
SCHEMBL5669798 0.67 MMP3 (0.44) MMP3CYP2C19ALDH1A1CHRM4
SCHEMBL941517 0.67 MMP3 (0.45) MMP3SMN1; SMN2USP5DRD2KMT2A

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-20040127528-A1 Metalloproteinase inhibitors ASTRAZENECA AB (SE) 2004-07-01 US disclosed
EP-1370536-A1 METALLOPROTEINASE INHIBITORS AstraZeneca AB (SE) 2003-12-17 EP disclosed
WO-2002074750-A1 METALLOPROTEINASE INHIBITORS ASTRAZENECA AB (SE) 2002-09-26 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-20040127528-A1 Metalloproteinase inhibitors MMP9, MMP10, MMP3 MMP3 3/4885POLB 1172/4885RORC 3207/4885

“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.