SCHEMBL6358085

SCHEMBL6358085

COC(=O)N1CCC(CSC(C)=O)(C(=O)OC)CC1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 7/20 0.42
CYP2C9 P11712 3/20 0.40
USP2 O75604 2/20 0.40
CYP1A2 P05177 2/20 0.40
CYP3A4 P08684 7/20 0.38
CYP2C19 P33261 5/20 0.38
MAPK1 P28482 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
HSD17B10 Q99714 2/20 0.37
TSHR P16473 3/20 0.36
HIF1A Q16665 1/20 0.36
ALDH1A1 P00352 2/20 0.34

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
SCHEMBL13048725 0.84 CYP4F2 (0.43)
SCHEMBL6278795 0.80 ADAM10 (0.45)
SCHEMBL3725050 0.79 CYP4F2 (0.47) CYP3A4CYP2C19MEN1KMT2AALDH1A1
SCHEMBL3960309 0.78 CYP2D6 (0.46) CYP2D6CYP2C9USP2CYP1A2CYP3A4
SCHEMBL6730542 0.76 CYP3A4 (0.35) CYP2C9CYP3A4CYP2C19
SCHEMBL23268335 0.74 CYP4F2 (0.39) USP2MEN1KMT2AALDH1A1
SCHEMBL5317700 0.73 CYP2D6 (0.42) CYP2D6CYP2C9USP2CYP1A2CYP3A4
SCHEMBL5321362 0.71
SCHEMBL28877805 0.68 USP2 (0.47) CYP2D6CYP2C9USP2CYP1A2CYP3A4
SCHEMBL6888380 0.68 LTA4H (0.39) CYP2D6USP2CYP1A2CYP2C19MAPK1

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-20050250789-A1 Hydroxamic acid derivatives as metalloprotease inhibitors INCYTE CORPORATION 2005-11-10 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-20050250789-A1 Hydroxamic acid derivatives as metalloprotease inhibitors MMP9, MMP17, MMP25 CYP2D6 1191/4885CYP2C9 449/4885USP2 2343/4885

“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.