SCHEMBL5898978

SCHEMBL5898978

COc1ccc(S(=O)(=O)N2CCC(Oc3ccc(-c4cccc(C(F)(F)F)c4)cc3)CC2)c(C(=O)NO)c1OC

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 8/20 0.60
MMP2 P08253 6/20 0.60
KMT2A Q03164 3/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
MEN1 O00255 2/20 0.52
LMNA P02545 2/20 0.52
MAPT P10636 2/20 0.52
TSHR P16473 1/20 0.52
MAPK1 P28482 1/20 0.52
TP53 P04637 1/20 0.43
EPHX2 P34913 1/20 0.41
GAA P10253 1/20 0.40
MMP1 P03956 2/20 0.40
MMP9 P14780 2/20 0.40
ADAM17 P78536 2/20 0.40
HSD17B10 Q99714 1/20 0.40
PLG P00747 1/20 0.39
PLAU P00749 1/20 0.39
PLAT P00750 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
SCHEMBL5898986 0.90 MMP13 (0.69) MMP13MMP2KMT2ASMN1; SMN2MEN1
SCHEMBL6572436 0.89 MMP2 (0.53) MMP13MMP2KMT2ASMN1; SMN2MAPT
SCHEMBL5899028 0.85 MMP2 (0.55) MMP13MMP2KMT2ASMN1; SMN2MEN1
SCHEMBL8361679 0.84 MMP13 (0.64) MMP13MMP2KMT2ASMN1; SMN2MEN1
SCHEMBL6605195 0.84 MMP2 (0.51) MMP13MMP2KMT2ASMN1; SMN2MEN1
SCHEMBL8361646 0.84 MMP2 (0.51) MMP13MMP2KMT2ASMN1; SMN2MAPT
SCHEMBL5898944 0.83 MMP2 (0.54) MMP13MMP2KMT2ASMN1; SMN2MAPT
SCHEMBL5898993 0.83 MMP2 (0.49) MMP13MMP2KMT2ASMN1; SMN2MEN1
SCHEMBL8363785 0.83 MMP2 (0.51) MMP13MMP2KMT2ASMN1; SMN2MEN1
SCHEMBL8364987 0.82 MMP13 (0.78) MMP13MMP2KMT2ASMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7115632-B1 Sulfonyl aryl or heteroaryl hydroxamic acid compounds G. D. SEARLE & CO. (US) 2006-10-03 US disclosed
EP-1406602-A2 USE OF SULFONYL ARYL OR HETEROARYL HYDROXAMIC ACIDS AND DERIVATIVES THEREOF AS AGGRECANASE INHIBITORS Pharmacia Corporation (US) 2004-04-14 EP disclosed
EP-1406626-A2 SULPHONYL ARYL HYDROXAMATES AND THEIR USE AS MMP INHIBITORS Pharmacia Corporation (US) 2004-04-14 EP disclosed
US-6696449-B2 CONTROL DEGRADATION OF CONENCTING TISSUE; CARDIOVASCULAR DISORDERS PHARMACIA CORPORATION 2004-02-24 US disclosed
US-20030171404-A1 Use of sulfonyl aryl or heteroaryl hydroxamic acids and derivatives thereof as aggrecanase inhibitors PHARMACIA CORPORATION 2003-09-11 US disclosed
US-20030073845-A1 Sulfonyl aryl hydroxamates and their use as matrix metalloprotease inhibitors PHARMACIA CORPORATION 2003-04-17 US disclosed
WO-2003007930-A2 USE OF SULFONYL ARYL OR HETEROARYL HYDROXAMIC ACIDS AND DERIVATIVES THEREOF AS AGGRECANASE INHIBITORS PHARMACIA CORPORATION (US) 2003-01-30 WO disclosed
WO-2003007954-A2 SULFONYL ARYL HYDROXAMATES AND THEIR USE AS MATRIX METALLOPROTEASE INHIBITORS PHARMACIA CORPORATION (US) 2003-01-30 WO disclosed
WO-2003007954-A2 SULFONYL ARYL HYDROXAMATES AND THEIR USE AS MATRIX METALLOPROTEASE INHIBITORS PHARMACIA CORPORATION (US) 2003-01-30 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-20030073845-A1 Sulfonyl aryl hydroxamates and their use as matrix metalloprotease inhibitors ARSA, MMP1, MMP3 MMP13 8/4885MMP2 7/4885KMT2A 733/4885
US-20030171404-A1 Use of sulfonyl aryl or heteroaryl hydroxamic acids and derivatives thereof as aggrecanase inhibitors ARSA, AADAC, ASPH MMP13 26/4885MMP2 27/4885KMT2A 1379/4885

“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.