SCHEMBL5282279

SCHEMBL5282279

O=C(O)CCCCCNC(=O)COCc1ccc(F)cc1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 1/20 0.47
ITGA2B P08514 1/20 0.47
HTT P42858 2/20 0.47
RAB9A P51151 1/20 0.46
MAPK1 P28482 1/20 0.46
HDAC1 Q13547 2/20 0.45
HDAC3 O15379 1/20 0.45
HDAC2 Q92769 1/20 0.45
HDAC8 Q9BY41 1/20 0.45
LMNA P02545 5/20 0.44
TSHR P16473 1/20 0.44
ATM Q13315 1/20 0.43
KMT2A Q03164 1/20 0.42
HPGD P15428 1/20 0.42
PRMT1 Q99873 1/20 0.41

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
SCHEMBL5278715 0.88 RAB9A (0.45) RAB9AHDAC1HDAC3HDAC2HDAC8
SCHEMBL5278052 0.88 ATM (0.57) ITGB3ITGA2BHTTMAPK1HDAC1
SCHEMBL5287500 0.86 RAB9A (0.43) RAB9AHDAC1HDAC3HDAC2HDAC8
SCHEMBL5287408 0.85 RAB9A (0.47) RAB9AHDAC1HDAC3HDAC2HDAC8
SCHEMBL5286752 0.85 RAB9A (0.47) RAB9AHDAC1HDAC3HDAC2HDAC8
SCHEMBL5280483 0.84 RAB9A (0.48) RAB9ALMNAKMT2AHPGD
SCHEMBL6037902 0.83 RAB9A (0.50) RAB9ALMNAKMT2AHPGD
SCHEMBL5287584 0.83 RAB9A (0.45) RAB9AHDAC1HDAC3HDAC2HDAC8
SCHEMBL5278754 0.83 RAB9A (0.45) RAB9AHDAC1HDAC3HDAC2HDAC8
SCHEMBL5278625 0.81 ASAH1 (0.54) HTTHDAC1HDAC3HDAC2HDAC8

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-1863804-A1 INHIBITORS OF HISTONE DEACETYLASE Methylgene, Inc. (CA) 2007-12-12 EP disclosed
US-20060264415-A1 Inhibitors of histone deacetylase METHYLGENE INC. 2006-11-23 US disclosed
WO-2006102760-A1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2006-10-05 WO disclosed
WO-2006102760-A1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2006-10-05 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-20060264415-A1 Inhibitors of histone deacetylase HDAC1, HDAC3, HDAC11 ITGB3 2934/4885ITGA2B 3000/4885HTT 846/4885

“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.