SCHEMBL4409153

SCHEMBL4409153

O=C(O)CCCCC[C@H](NC(=O)OCc1ccccc1)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 6/20 0.67
SIRT2 Q8IXJ6 3/20 0.66
SIRT1 Q96EB6 2/20 0.66
SIRT5 Q9NXA8 2/20 0.58
HTT P42858 1/20 0.57
SIRT3 Q9NTG7 1/20 0.56
MME P08473 1/20 0.53
ECE1 P42892 1/20 0.53
ITGB3 P05106 3/20 0.53
ITGAV P06756 2/20 0.53
CTSL P07711 1/20 0.53
CTSS P25774 1/20 0.53
ITGA2B P08514 1/20 0.53

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
SCHEMBL5323583 1.00 FOLH1 (0.67) FOLH1SIRT2SIRT1SIRT5HTT
SCHEMBL9828826 0.99 FOLH1 (0.69) FOLH1SIRT2SIRT1SIRT5HTT
SCHEMBL5711292 0.99 FOLH1 (0.69) FOLH1SIRT2SIRT1SIRT5HTT
SCHEMBL5711173 0.95 FOLH1 (0.67) FOLH1SIRT2SIRT1SIRT5HTT
SCHEMBL5711264 0.95 FOLH1 (0.67) FOLH1SIRT2SIRT1SIRT5HTT
SCHEMBL6278137 0.95 FOLH1 (0.67) FOLH1SIRT2SIRT1SIRT5HTT
SCHEMBL8387978 0.92 FOLH1 (0.65) FOLH1SIRT2SIRT1SIRT5ECE1
SCHEMBL910423 0.89 FOLH1 (0.70) FOLH1SIRT2SIRT1MMEECE1
SCHEMBL910232 0.89 FOLH1 (0.70) FOLH1SIRT2SIRT1MMEECE1
SCHEMBL910233 0.89 FOLH1 (0.70) FOLH1SIRT2SIRT1MMEECE1

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-4086272-A1 METHODS FOR PRODUCING CYCLIC COMPOUNDS COMPRISING N-SUBSTITUTED AMINO ACID RESIDUES Chugai Seiyaku Kabushiki Kaisha (JP) 2022-11-09 EP disclosed
US-20090048228-A1 Heterocycle Derivatives As Histone Deacetylase (Hdac) Inhibitors MSD ITALIA S.R.L. (IT) 2009-02-19 US disclosed
WO-2007143822-A1 SULFAMIDE AND SULFAMATE DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS METHYLGENE INC. (CA) 2007-12-21 WO disclosed
US-20070293530-A1 SULFAMIDE AND SULFAMATE DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS METHYLGENE INC. (CA) 2007-12-20 US disclosed
US-20070293530-A1 SULFAMIDE AND SULFAMATE DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS METHYLGENE INC. (CA) 2007-12-20 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 (2 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-20090048228-A1 Heterocycle Derivatives As Histone Deacetylase (Hdac) Inhibitors HDAC1, HDAC5, HDAC11 FOLH1 2876/4885SIRT2 44/4885SIRT1 21/4885
US-20070293530-A1 SULFAMIDE AND SULFAMATE DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS HDAC1, HDAC11, HAT1 FOLH1 2522/4885SIRT2 52/4885SIRT1 34/4885

“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.