SCHEMBL2425461

SCHEMBL2425461

CC(C)(C)OC(=O)C1NCSC1(C)C

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.34
CHRM2 P08172 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRM3 P20309 1/20 0.30

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
SCHEMBL2425462 1.00 MAPK1 (0.34) MAPK1CHRM2CHRM1CHRM3
SCHEMBL6161938 1.00 MAPK1 (0.34) MAPK1CHRM2CHRM1CHRM3
SCHEMBL6108339 0.83 MAPK1 (0.33) MAPK1CHRM2CHRM1CHRM3
SCHEMBL6432031 0.83 MAPK1 (0.33) MAPK1CHRM2CHRM1CHRM3
SCHEMBL14570178 0.80 KMT2A (0.40)
SCHEMBL9036688 0.80 KMT2A (0.40)
SCHEMBL9645913 0.76 LMNA (0.36)
SCHEMBL9645916 0.76 LMNA (0.36)
SCHEMBL950964 0.74 HTT (0.35)
SCHEMBL951739 0.74 HTT (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110218236-A1 COMPOUND AND COMPOSITION AND THEIR USES THEREOF KRISHANI BIOSCIENCES (P) LTD (IN) 2011-09-08 US disclosed
US-20110218237-A1 COMPOUND AND COMPOSITION AND THEIR USES THEREOF KRISHANI BIOSCIENCES (P) LTD. (IN) 2011-09-08 US disclosed
US-20110218237-A1 COMPOUND AND COMPOSITION AND THEIR USES THEREOF KRISHANI BIOSCIENCES (P) LTD. (IN) 2011-09-08 US disclosed
US-20110218236-A1 COMPOUND AND COMPOSITION AND THEIR USES THEREOF KRISHANI BIOSCIENCES (P) LTD (IN) 2011-09-08 US disclosed
US-20110218235-A1 COMPOUND AND COMPOSITION AND THEIR USES THEREOF KRISHANI BIOSCIENCES (P) LTD (IN) 2011-09-08 US disclosed
US-20110218235-A1 COMPOUND AND COMPOSITION AND THEIR USES THEREOF KRISHANI BIOSCIENCES (P) LTD (IN) 2011-09-08 US disclosed
EP-1233017-B1 Tricyclic sulfonamides useful as matrix metalloproteinase inhibitors WARNER LAMBERT CO (US) 2005-12-14 EP disclosed
US-6559142-B2 Tricyclic substituted cyclic sulfonamides compound is useful for treating heart disease, multiple sclerosis, arthritis, atherosclerosis, and osteoporosis WARNER-LAMBERT COMPANY 2003-05-06 US disclosed
US-20020169160-A1 Sulfonamide matrix metalloproteinase inhibitors O'BRIEN PATRICK MICHAEL (US) 2002-11-14 US disclosed
EP-1233017-A1 Tricyclic sulfonamides useful as matrix metalloproteinase inhibitors WARNER-LAMBERT COMPANY (US) 2002-08-21 EP 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 (4 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-20110218237-A1 COMPOUND AND COMPOSITION AND THEIR USES THEREOF SLC26A4, SLC26A3, SLC10A1 MAPK1 2823/4885CHRM2 919/4885CHRM1 659/4885
US-20110218236-A1 COMPOUND AND COMPOSITION AND THEIR USES THEREOF SLC26A4, SLC26A3, SLC10A1 MAPK1 2823/4885CHRM2 919/4885CHRM1 659/4885
US-20020169160-A1 Sulfonamide matrix metalloproteinase inhibitors MMP9, MMP10, MMP3 MAPK1 2107/4885CHRM2 4004/4885CHRM1 4356/4885
US-20110218235-A1 COMPOUND AND COMPOSITION AND THEIR USES THEREOF SLC10A1, CYP7A1, SLC39A11 MAPK1 4242/4885CHRM2 1872/4885CHRM1 1460/4885

“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.