SCHEMBL194097

SCHEMBL194097

CC(C)(C)OC(=O)NC(CC1CCC(Oc2ccc(C(N)C(=O)OCc3ccccc3)cc2)CC1)C(=O)OC1CCCC1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CACNA1B Q00975 6/20 0.51
▸ CTSL P07711 4/20 0.44
▸ CTSS P25774 4/20 0.44
▸ CTSK P43235 4/20 0.44
▸ KLK7 P49862 4/20 0.42
▸ KLK5 Q9Y337 3/20 0.42
▸ CTSB P07858 1/20 0.40
▸ HTRA1 Q92743 1/20 0.39
▸ PDE4B Q07343 1/20 0.39
▸ REN P00797 1/20 0.39

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
SCHEMBL194098 0.87 CACNA1B (0.53) CACNA1BCTSLCTSSCTSKKLK7
SCHEMBL191340 0.83 CACNA1B (0.51) CACNA1BCTSSCTSKREN
SCHEMBL191339 0.83 CACNA1B (0.51) CACNA1BCTSSCTSKREN
SCHEMBL13260654 0.79 CACNA1B (0.52) CACNA1BCTSLKLK7KLK5PDE4B
SCHEMBL7421510 0.79 CACNA1B (0.57) CACNA1BCTSLCTSSCTSKKLK7
SCHEMBL3817672 0.79 CTSS (0.54) CACNA1BCTSLCTSSCTSKKLK7
SCHEMBL7862381 0.78 CTSS (0.57) CACNA1BCTSLCTSSCTSKKLK7
SCHEMBL5344860 0.76 CACNA1B (0.69) CACNA1BCTSLCTSSCTSKKLK7
SCHEMBL5350386 0.76 CACNA1B (0.69) CACNA1BCTSLCTSSCTSKKLK7
SCHEMBL376038 0.75 ITGB3 (0.51) CACNA1BCTSLCTSSCTSKKLK7

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-20090298924-A1 HYDROXAMIC ACID DERIVATIVES AS INHIBITORS OF HDAC ENZYMATIC ACTIVITY CHROMA THERAPEUTICS LTD (GB) 2009-12-03 — — US disclosed
EP-1877366-A1 HYDROXAMIC ACID DERVICATIVES AS INHIBITORS OF HDAC ENZYMATIC ACTIVITY Chroma Therapeutics Limited (GB) 2008-01-16 — — EP disclosed
WO-2006117548-A1 HYDROXAMIC ACID DERVICATIVES AS INHIBITORS OF HDAC ENZYMATIC ACTIVITY CHROMA THERAPEUTICS LTD (GB) 2006-11-09 — — 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-20090298924-A1 HYDROXAMIC ACID DERIVATIVES AS INHIBITORS OF HDAC ENZYMATIC ACTIVITY HDAC1, HDAC3, HAT1 CACNA1B 2547/4885CTSL 1280/4885CTSS 901/4885

“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.

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