SCHEMBL5283411

SCHEMBL5283411

Cc1[nH]c2ccccc2c1CCNCc1ccc(CCCNC(=O)COCc2ccc(F)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 14/20 0.51
HDAC3 O15379 13/20 0.51
HDAC2 Q92769 13/20 0.51
NCOR2 Q9Y618 10/20 0.51
HDAC8 Q9BY41 4/20 0.51
HDAC4 P56524 3/20 0.51
HDAC6 Q9UBN7 3/20 0.51
HDAC7 Q8WUI4 2/20 0.51
HDAC10 Q969S8 2/20 0.51
HDAC11 Q96DB2 2/20 0.51
HDAC9 Q9UKV0 2/20 0.51
HDAC5 Q9UQL6 2/20 0.51
TET3 O43151 1/20 0.51
BRD4 O60885 1/20 0.51
FOXO1 Q12778 1/20 0.51
TET2 Q6N021 1/20 0.51
PIK3C3 Q8NEB9 1/20 0.51
TET1 Q8NFU7 1/20 0.51
MAPT P10636 1/20 0.45
TDP1 Q9NUW8 1/20 0.45

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
SCHEMBL5278722 0.87 HDAC1 (0.49) HDAC1HDAC3HDAC2NCOR2HDAC8
SCHEMBL6038097 0.82 KMT2A (0.54) HDAC1HDAC3HDAC2HDAC8HDAC4
SCHEMBL6038326 0.80 POLB (0.55)
SCHEMBL6038081 0.80 SSTR3 (0.52) HDAC1HDAC3HDAC2HDAC8HDAC4
SCHEMBL5277774 0.78 LMNA (0.51) MAPT
SCHEMBL6038389 0.77 HDAC3 (0.50) HDAC1HDAC3HDAC2HDAC8HDAC4
SCHEMBL6037933 0.77 GFER (0.53) MAPTTDP1
SCHEMBL6037945 0.77 GFER (0.56) HDAC1HDAC3HDAC2HDAC8HDAC4
SCHEMBL5410184 0.77 BCHE (0.52) HDAC1HDAC3HDAC2MAPTTDP1
SCHEMBL6038089 0.76 MPO (0.43) HDAC1HDAC3HDAC2HDAC8HDAC4

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 3 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 claimed
US-20060264415-A1 Inhibitors of histone deacetylase METHYLGENE INC. 2006-11-23 US claimed
WO-2006102760-A1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2006-10-05 WO claimed

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 HDAC1 1/4885HDAC3 2/4885HDAC2 5/4885

“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.