SCHEMBL30656002

SCHEMBL30656002

CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)Oc1c(F)c(F)c(F)c(F)c1F

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CTSB P07858 5/20 0.55
CTSL P07711 4/20 0.55
CTSS P25774 4/20 0.55
CTSK P43235 4/20 0.55
ELANE P08246 2/20 0.50
PRTN3 P24158 1/20 0.50
ATM Q13315 1/20 0.50
CASP3 P42574 3/20 0.49
CASP1 P29466 2/20 0.49
CASP7 P55210 2/20 0.49
CASP6 P55212 2/20 0.49
CASP8 Q14790 2/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
CASP9 P55211 1/20 0.49
CA2 P00918 1/20 0.49
CA5A P35218 1/20 0.49
CAPN1 P07384 1/20 0.48
LMNA P02545 1/20 0.48

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
SCHEMBL11672320 0.86 CTSL (0.54) CTSBCTSLCTSSCTSKELANE
SCHEMBL12292819 0.85 SYK (0.50) CTSBCTSLCTSSCTSKELANE
SCHEMBL25651237 0.84 CTSS (0.45) CTSBCTSLCTSSCTSKATM
SCHEMBL25651236 0.84 CTSS (0.45) CTSBCTSLCTSSCTSKATM
SCHEMBL28892051 0.84 TRPM8 (0.62) CTSBCTSLCTSSCTSKELANE
SCHEMBL1908598 0.84 CTSK (0.62) CTSBCTSLCTSSCTSKELANE
SCHEMBL10535596 0.84 TRPM8 (0.62) CTSBCTSLCTSSCTSKELANE
SCHEMBL10535601 0.84 TRPM8 (0.62) CTSBCTSLCTSSCTSKELANE
SCHEMBL5120950 0.82 CTSL (0.60) CTSBCTSLCTSSCTSKELANE
SCHEMBL5338870 0.82 CTSL (0.60) CTSBCTSLCTSSCTSKELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250170252-A1 QUINONE PROTECTED FORMS AND CONJUGATES CAMBRIDGE ENTERPRISE LIMITED (GB) 2025-05-29 US disclosed
EP-4532480-A1 QUINONE PROTECTED FORMS AND CONJUGATES Cambridge Enterprise Limited (GB) 2025-04-09 EP disclosed
WO-2023227757-A1 QUINONE PROTECTED FORMS AND CONJUGATES CAMBRIDGE ENTERPRISE LIMITED (GB) 2023-11-30 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 (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-20250170252-A1 QUINONE PROTECTED FORMS AND CONJUGATES NQO1, SQOR, GSTP1 CTSB 3615/4885CTSL 4052/4885CTSS 3136/4885

“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.