SCHEMBL4298802

SCHEMBL4298802

O=[N+]([O-])c1ccc(S(=O)(=O)N2CC2Cc2cccc(Cl)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 3/20 0.46
CMA1 P23946 1/20 0.43
NPBWR1 P48145 1/20 0.42
MCHR1 Q99705 1/20 0.42
FAAH O00519 1/20 0.42
CYP19A1 P11511 1/20 0.41
ALDH1A1 P00352 4/20 0.41
TDP1 Q9NUW8 1/20 0.41
RECQL P46063 1/20 0.40
KDM4E B2RXH2 1/20 0.40
HSP90AA1 P07900 1/20 0.40
KMT2A Q03164 1/20 0.40
TXNRD1 Q16881 1/20 0.40
TERT O14746 1/20 0.39
MMP1 P03956 1/20 0.39
MMP7 P09237 1/20 0.39
MMP9 P14780 1/20 0.39
MMP12 P39900 1/20 0.39
MMP14 P50281 1/20 0.39
MMP15 P51511 1/20 0.39

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
SCHEMBL4298798 1.00 MMP2 (0.46) MMP2CMA1NPBWR1MCHR1FAAH
SCHEMBL6652989 0.85 MMP2 (0.61) MMP2CMA1ALDH1A1TDP1HSP90AA1
SCHEMBL28547906 0.77 ALDH1A1 (0.58) MMP2FAAHALDH1A1TDP1RECQL
SCHEMBL29620268 0.77 ALDH1A1 (0.58) MMP2FAAHALDH1A1TDP1RECQL
SCHEMBL1596115 0.75 MMP2 (0.46) MMP2ALDH1A1TDP1MMP1PARL
SCHEMBL1596117 0.75 MMP2 (0.46) MMP2ALDH1A1TDP1MMP1PARL
SCHEMBL16299053 0.74 ALDH1A1 (0.74) ALDH1A1KDM4E
SCHEMBL28453189 0.74 ACHE (0.51) MMP2ALDH1A1TDP1RECQLPARL
SCHEMBL1185663 0.73 CMA1 (0.82) CMA1
SCHEMBL7122701 0.71 ACHE (0.65) MMP2ALDH1A1TDP1RECQLPARL

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
EP-1981884-B1 THIAZOLE COMPOUNDS AS PROTEIN KINASE B (PKB) INHIBITORS AMGEN INC (US) 2012-06-13 EP disclosed
US-8084479-B2 Thiazole compounds and methods of use AMGEN INC. (US) 2011-12-27 US disclosed
US-20090270445-A1 Thiazole compounds and methods of use AMGEN INC. (US) 2009-10-29 US disclosed
US-7514566-B2 Thiazole compounds and methods of use AMGEN, INC. (US) 2009-04-07 US disclosed
EP-1981884-A2 THIAZOLE COMPOUNDS AS PROTEIN KINASE B (PKB) INHIBITORS Amgen, Inc (US) 2008-10-22 EP disclosed
WO-2007084391-A2 THIAZOLE COMPOUNDS AS PROTEIN KINASE B ( PKB) INHIBITORS AMGEN INC. (US) 2007-07-26 WO disclosed
US-20070173506-A1 Thiazole compounds and methods of use AMGEN INC. (US) 2007-07-26 US 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-20090270445-A1 Thiazole compounds and methods of use MTOR, JAK2, TK2 MMP2 2537/4885CMA1 3601/4885NPBWR1 1643/4885
US-20070173506-A1 Thiazole compounds and methods of use MTOR, JAK2, PCK2 MMP2 2809/4885CMA1 2766/4885NPBWR1 1336/4885

“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.