SCHEMBL2740271

SCHEMBL2740271

CC(C)(C)OC(=O)N[C@H](C(=O)OC1CCCC1)C1C=CC(Oc2ccc(CNC(=O)OCc3ccccc3)cc2)=CC1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CACNA1B Q00975 5/20 0.46
▸ REN P00797 1/20 0.40
▸ NTSR1 P30989 1/20 0.39
▸ CTSL P07711 2/20 0.38
▸ MAPT P10636 1/20 0.38
▸ SYK P43405 1/20 0.38
▸ KLK7 P49862 2/20 0.37
▸ KLK5 Q9Y337 2/20 0.37
▸ POLB P06746 1/20 0.37
▸ GPR55 Q9Y2T6 1/20 0.37
▸ TACR1 P25103 1/20 0.36
▸ ITGB3 P05106 1/20 0.36
▸ ITGA2B P08514 1/20 0.36
▸ CMA1 P23946 1/20 0.36
▸ CTSS P25774 1/20 0.36
▸ CTSK P43235 1/20 0.36

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
SCHEMBL8249430 0.85 CACNA1B (0.44) CACNA1BRENCTSL
SCHEMBL2740593 0.85 CACNA1B (0.45) CACNA1BCTSLMAPTSYKKLK7
SCHEMBL193335 0.81 CACNA1B (0.52) CACNA1BRENNTSR1SYKKLK7
SCHEMBL193334 0.81 CACNA1B (0.52) CACNA1BRENNTSR1SYKKLK7
SCHEMBL376125 0.77 CACNA1B (0.56) CACNA1BRENMAPTKLK7KLK5
SCHEMBL376126 0.77 CACNA1B (0.56) CACNA1BRENMAPTKLK7KLK5
SCHEMBL2740739 0.76 CTSL (0.46) NTSR1CTSLMAPTSYKKLK7
SCHEMBL194098 0.75 CACNA1B (0.53) CACNA1BRENCTSLKLK7KLK5
SCHEMBL2740741 0.73 CACNA1B (0.41) CACNA1BCTSLCTSSCTSK
SCHEMBL2740740 0.73 PPARA (0.45) CTSLMAPTSYKKLK7KLK5

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 4 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
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 2547/4885REN 2769/4885NTSR1 875/4885

“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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