SCHEMBL4986992

SCHEMBL4986992

CC(C)C[C@@H](C(=O)N(C)[C@@H](Cc1ccccc1)C(N)=O)[C@H](CSc1cccs1)C(=O)NO

nearest known ligand 0.73

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FCER2 P06734 13/20 0.73
MMP1 P03956 10/20 0.73
MMP2 P08253 6/20 0.66
MMP9 P14780 4/20 0.66
MMP3 P08254 3/20 0.64
MMP7 P09237 3/20 0.64
MMP8 P22894 2/20 0.64
MMP13 P45452 2/20 0.64
MMP14 P50281 2/20 0.64
ADAM17 P78536 2/20 0.64

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
SCHEMBL3498528 0.81 MMP1 (0.61) FCER2MMP1MMP2MMP9MMP3
SCHEMBL15813401 0.81 MMP1 (0.61) FCER2MMP1MMP2MMP9MMP3
Batimastat SCHEMBL17521974 0.78 MMP1 (1.00) FCER2MMP1MMP2MMP9MMP3
Batimastat SCHEMBL20793035 0.78 MMP1 (1.00) FCER2MMP1MMP2MMP9MMP3
Batimastat SCHEMBL10052355 0.78 MMP1 (1.00) FCER2MMP1MMP2MMP9MMP3
Batimastat SCHEMBL12561510 0.78 MMP1 (1.00) FCER2MMP1MMP2MMP9MMP3
Batimastat SCHEMBL4333 0.78 MMP1 (1.00) FCER2MMP1MMP2MMP9MMP3
Batimastat SCHEMBL22803645 0.78 MMP1 (1.00) FCER2MMP1MMP2MMP9MMP3
Batimastat SCHEMBL12336015 0.78 MMP1 (1.00) FCER2MMP1MMP2MMP9MMP3
Batimastat SCHEMBL4332 0.78 MMP1 (1.00) FCER2MMP1MMP2MMP9MMP3

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-20080125469-A1 Thiadiazole compounds and methods of use thereof WYETH (US) 2008-05-29 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 (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-20080125469-A1 Thiadiazole compounds and methods of use thereof ADAMTS5, ADAMTS1, TIMP3 FCER2 3362/4885MMP1 23/4885MMP2 29/4885

“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.