SCHEMBL3868533

SCHEMBL3868533

CC(C)(SCCN1CCOCC1)[C@@H](NS(=O)(=O)c1cc(F)c(Oc2ccc(F)cc2)c(F)c1)C(=O)NO

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 7/20 0.38
MMP13 P45452 7/20 0.38
MMP2 P08253 5/20 0.38
MMP14 P50281 2/20 0.38
BMP1 P13497 1/20 0.36
MMP1 P03956 5/20 0.36
ADAM17 P78536 2/20 0.36
SCN9A Q15858 1/20 0.36
MMP3 P08254 2/20 0.35
MMP8 P22894 1/20 0.35
MMP12 P39900 1/20 0.35
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
HTR7 P34969 1/20 0.35
TACR2 P21452 1/20 0.35

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
SCHEMBL3880329 0.91 MMP13 (0.39) MMP9MMP13MMP2MMP14BMP1
SCHEMBL3878923 0.81 MMP9 (0.41) MMP9MMP13MMP2MMP14BMP1
SCHEMBL3870206 0.79 ALDH1A1 (0.43) MMP9MMP13MMP2MMP14MMP1
SCHEMBL1800363 0.79 MEN1 (0.37) MMP9MMP13MMP2MMP14BMP1
SCHEMBL7249318 0.78 ADAM17 (0.63) MMP9MMP13MMP2MMP14MMP1
SCHEMBL3878903 0.73 ALDH1A1 (0.42) MMP9MMP13MMP2MMP14MMP1
SCHEMBL4299834 0.73 TACR2 (0.42) MMP9MMP13MMP2MMP14SCN9A
SCHEMBL1797411 0.71 ADAMTS7 (0.49) MMP9MMP13MMP2MMP14MMP1
SCHEMBL1797412 0.71 ADAMTS7 (0.49) MMP9MMP13MMP2MMP14MMP1
SCHEMBL1800796 0.71 MMP1 (0.48) MMP9MMP13MMP2MMP1ADAM17

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090143386-A1 Human adam-10 inhibitors EXELIXIS, INC. 2009-06-04 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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-20090143386-A1 Human adam-10 inhibitors ADAM10, ADAM12, CASP10 MMP9 82/4885MMP13 97/4885MMP2 203/4885

“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.