SCHEMBL1067926

SCHEMBL1067926

COc1ccc(NCc2ccc(C(=O)Nc3ccccc3F)cc2)cc1OC

nearest known ligand 0.80

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 15/20 0.80
HDAC2 Q92769 7/20 0.80
KDM4E B2RXH2 2/20 0.64
MEN1 O00255 1/20 0.64
NPC1 O15118 1/20 0.64
CASP3 P42574 1/20 0.64
RAB9A P51151 1/20 0.64
KMT2A Q03164 1/20 0.64
SENP7 Q9BQF6 1/20 0.64
PDE4D Q08499 1/20 0.54
ALDH1A1 P00352 1/20 0.54
NR1H4 Q96RI1 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
SCHEMBL1064557 0.89 HDAC1 (1.00) HDAC1HDAC2
SCHEMBL1079414 0.88 HDAC1 (1.00) HDAC1HDAC2NR1H4
SCHEMBL12933547 0.88 HDAC1 (0.80) HDAC1HDAC2NPC1RAB9APDE4D
SCHEMBL1064299 0.85 HDAC1 (0.77) HDAC1HDAC2
SCHEMBL211732 0.85 HDAC1 (0.84) HDAC1HDAC2
SCHEMBL1064879 0.83 HDAC1 (0.73) HDAC1HDAC2NR1H4
SCHEMBL1060645 0.83 HDAC1 (1.00) HDAC1HDAC2
SCHEMBL1067792 0.83 HDAC1 (0.66) HDAC1HDAC2MEN1NPC1RAB9A
SCHEMBL12933622 0.83 HDAC1 (0.73) HDAC1HDAC2
SCHEMBL1065868 0.82 HDAC1 (0.79) HDAC1HDAC2NPC1CASP3RAB9A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7868205-B2 Inhibitors of histone deacetylase METHYLGENE INC. (CA) 2011-01-11 US disclosed
US-20080132459-A1 Inhibitors of Histone Deacetylase METHYLGENE, INC. (CA) 2008-06-05 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 (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-20080132459-A1 Inhibitors of Histone Deacetylase HDAC1, HDAC5, HDAC3 HDAC1 1/4885HDAC2 5/4885KDM4E 123/4885

“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.