SCHEMBL4900595

SCHEMBL4900595

[CH2]CNS(=O)(=O)NC(=O)OC(C)C

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA14 Q9ULX7 7/20 0.37
CA12 O43570 6/20 0.37
CA2 P00918 3/20 0.37
CA7 P43166 3/20 0.33
CA9 Q16790 2/20 0.33
CA1 P00915 3/20 0.33
TSHR P16473 1/20 0.32
ACHE P22303 2/20 0.32
HPGD P15428 2/20 0.32
ALOX15 P16050 1/20 0.32
NPC1 O15118 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL22854252 0.80 CA1 (0.48) CA14CA12CA2CA7CA9
SCHEMBL26444524 0.79 CA14 (0.42) CA14CA12CA2CA1TSHR
SCHEMBL26445212 0.76 TSHR (0.37) CA14CA12CA2CA7CA9
SCHEMBL26444534 0.74 CA12 (0.36) CA14CA12CA2CA7CA9
SCHEMBL22854030 0.73 MEN1 (0.36) CA14CA12CA2CA7CA9
SCHEMBL22854251 0.73 CA12 (0.35) CA14CA12CA2CA7CA9
SCHEMBL5639646 0.72 TSHR (0.37) CA14CA12CA2CA7CA9
SCHEMBL4900591 0.72 CA14 (0.33) CA14CA12TSHRHPGDNPC1
SCHEMBL1467804 0.71
SCHEMBL3629258 0.71 TSHR (0.40) CA14CA12CA2CA9CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080242656-A1 N-Substituted-N-Sulfonylaminocyclopropane Compounds and Pharmaceutical Use Thereof JAPAN TOBACCO INC. 2008-10-02 US disclosed
EP-1694638-A1 N-SUBSTITUTED-N-SULFONYLAMINOCYCLOPROPANE COMPOUNDS AND PHARMACEUTICAL USE THEREOF Japan Tobacco, Inc. (JP) 2006-08-30 EP disclosed
US-20050222146-A1 N-substituted-n-sulfonylaminocyclopropane compounds and pharmaceutical use thereof JAPAN TOBACCO INC. (JP) 2005-10-06 US disclosed
WO-2005058808-A1 N-SUBSTITUTED-N-SULFONYLAMINOCYCLOPROPANE COMPOUNDS AND PHARMACEUTICAL USE THEREOF JAPAN TOBACCO INC. (JP) 2005-06-30 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-20080242656-A1 N-Substituted-N-Sulfonylaminocyclopropane Compounds and Pharmaceutical Use Thereof MMP13, MMP11, MMP3 CA14 89/4885CA12 33/4885CA2 49/4885
US-20050222146-A1 N-substituted-n-sulfonylaminocyclopropane compounds and pharmaceutical use thereof MMP13, MMP11, MMP1 CA14 68/4885CA12 33/4885CA2 40/4885

“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.