SCHEMBL192406

SCHEMBL192406

CC(C)(C)OC(=O)N[C@H](C(=O)OCc1ccccc1)c1ccc(OCc2ccccc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CTSS P25774 2/20 0.54
CTSK P43235 1/20 0.54
ATM Q13315 1/20 0.51
SYK P43405 1/20 0.51
PRKCA P17252 1/20 0.51
PRKCD Q05655 1/20 0.51
LTA4H P09960 1/20 0.51
BCL2 P10415 1/20 0.51
CTSL P07711 1/20 0.50
PTPN1 P18031 1/20 0.49
ACACB O00763 1/20 0.48
PPARA Q07869 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
SCHEMBL192405 1.00 CTSS (0.54) CTSSCTSKATMSYKPRKCA
SCHEMBL2574965 0.93 CTSS (0.54) CTSSCTSKATMSYKPRKCA
SCHEMBL20439333 0.93 CTSS (0.54) CTSSCTSKATMSYKPRKCA
SCHEMBL2574963 0.93 CTSS (0.54) CTSSCTSKATMSYKPRKCA
SCHEMBL191549 0.92 ATM (0.55) CTSSCTSKATMPRKCAPRKCD
SCHEMBL191550 0.92 ATM (0.55) CTSSCTSKATMPRKCAPRKCD
SCHEMBL23837230 0.91 CTSS (0.60) CTSSCTSKATMSYKCTSL
SCHEMBL17724519 0.91 CTSS (0.60) CTSSCTSKATMSYKCTSL
SCHEMBL4689229 0.90 CTSS (0.53) CTSSCTSKATMSYKCTSL
SCHEMBL4689227 0.90 CTSS (0.53) CTSSCTSKATMSYKCTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1877366-B1 HYDROXAMIC ACID DERVICATIVES AS INHIBITORS OF HDAC ENZYMATIC ACTIVITY CHROMA THERAPEUTICS LTD (GB) 2012-01-04 EP disclosed
US-7973181-B2 Hydroxamic acid derivatives as inhibitors of HDAC enzymatic activity CHROMA THERAPEUTICS LTD. (GB) 2011-07-05 US disclosed
US-7973181-B2 Hydroxamic acid derivatives as inhibitors of HDAC enzymatic activity CHROMA THERAPEUTICS LTD. (GB) 2011-07-05 US disclosed
US-20090298924-A1 HYDROXAMIC ACID DERIVATIVES AS INHIBITORS OF HDAC ENZYMATIC ACTIVITY CHROMA THERAPEUTICS LTD (GB) 2009-12-03 US disclosed
US-20090298924-A1 HYDROXAMIC ACID DERIVATIVES AS INHIBITORS OF HDAC ENZYMATIC ACTIVITY CHROMA THERAPEUTICS LTD (GB) 2009-12-03 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-20090298924-A1 HYDROXAMIC ACID DERIVATIVES AS INHIBITORS OF HDAC ENZYMATIC ACTIVITY HDAC1, HDAC3, HAT1 CTSS 901/4885CTSK 2154/4885ATM 4078/4885

“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.