SCHEMBL4624980

SCHEMBL4624980

CS(=O)(=O)N(Cc1ccc(N)cc1)S(C)(=O)=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.44
APLNR P35414 1/20 0.43
RECQL P46063 1/20 0.42
TSHR P16473 4/20 0.41
CYP3A4 P08684 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
ALDH1A1 P00352 2/20 0.41
GFER P55789 1/20 0.41
GAA P10253 1/20 0.41
CA1 P00915 4/20 0.40
CA2 P00918 4/20 0.40
CA9 Q16790 4/20 0.40
CA7 P43166 3/20 0.40
LOXL2 Q9Y4K0 1/20 0.39
CA12 O43570 3/20 0.39
CA14 Q9ULX7 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
LMNA P02545 1/20 0.38
MPO P05164 1/20 0.38
CYP2C9 P11712 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
SCHEMBL4351827 0.82 MAPT (0.43) MAPTAPLNRRECQLTSHRCYP3A4
SCHEMBL7058633 0.79 ENPP2 (0.45) APLNRALDH1A1CA2
SCHEMBL2492170 0.78 TSHR (0.53) TSHRALDH1A1CA2CA9CA12
SCHEMBL514597 0.73 RECQL (0.48) MAPTRECQLTSHRCYP3A4TDP1
SCHEMBL4602672 0.72 SLC6A2 (0.43) CA1CA2CA9CA12
SCHEMBL16699980 0.72 BACE1 (0.50) MAPTCYP3A4ALDH1A1GFERGAA
SCHEMBL57323 0.70 HRH3 (0.64) MAPTTSHRCYP3A4TDP1ALDH1A1
SCHEMBL30925081 0.70 CA2 (0.35) APLNRALDH1A1CA1CA2CA9
SCHEMBL30925084 0.70 CA2 (0.38) RECQLCYP3A4TDP1ALDH1A1CA1
SCHEMBL30925088 0.70 CA2 (0.38) RECQLCYP3A4TDP1ALDH1A1CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8071650-B2 Vanilloid receptor modulators; analgesic, antiinflammatory and antiulcer effects; such as 1-(1H-indol-5-ylmethyl)-3-phenethylthiourea PACIFIC CORPORATION (KR) 2011-12-06 US disclosed
EP-1303483-B1 NOVEL THIOUREA DERIVATIVES AND THE PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME PACIFIC CORP (KR) 2008-04-23 EP disclosed
US-20080064687-A1 Novel thiourea derivatives and the pharmaceutical compositions containing the same SUH YOUNG G 2008-03-13 US disclosed
EP-1303483-A4 NOVEL THIOUREA DERIVATIVES AND THE PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME PACIFIC CORP (KR) 2004-11-03 EP disclosed
US-20030153596-A1 Novel thiourea derivatives and the pharmaceutical compositions containing the same PACIFIC CORPORATION (KR) 2003-08-14 US disclosed
EP-1303483-A1 NOVEL THIOUREA DERIVATIVES AND THE PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME PACIFIC CORPORATION (KR) 2003-04-23 EP disclosed
WO-2002016318-A1 NOVEL THIOUREA DERIVATIVES AND THE PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME PACIFIC CORPORATION (KR) 2002-02-28 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 (2 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-20030153596-A1 Novel thiourea derivatives and the pharmaceutical compositions containing the same TAS2R40, TAS1R2, TAS2R45 MAPT 1674/4885APLNR 444/4885RECQL 3625/4885
US-20080064687-A1 Novel thiourea derivatives and the pharmaceutical compositions containing the same TRPV1, TRPA1, TAS2R5 MAPT 3462/4885APLNR 1004/4885RECQL 3771/4885

“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.