SCHEMBL13784010

SCHEMBL13784010

O=C(NCCCCCCC(=O)c1ccccc1)Nc1ccccc1O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.54
LMNA P02545 2/20 0.54
MAPT P10636 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
HDAC1 Q13547 12/20 0.53
HDAC3 O15379 6/20 0.53
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
HDAC8 Q9BY41 10/20 0.51
HDAC2 Q92769 5/20 0.51
HDAC4 P56524 4/20 0.51
HDAC10 Q969S8 4/20 0.51
HDAC11 Q96DB2 4/20 0.51
HDAC6 Q9UBN7 4/20 0.51
HDAC9 Q9UKV0 4/20 0.51
HDAC5 Q9UQL6 4/20 0.51
HDAC7 Q8WUI4 3/20 0.51
NCOR2 Q9Y618 1/20 0.51
MARS1 P56192 1/20 0.50
KMT2A Q03164 1/20 0.47

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
SCHEMBL3383215 0.92 HDAC1 (0.55) L3MBTL1LMNAMAPTTDP1HDAC1
SCHEMBL3383335 0.85 HDAC1 (0.71) HDAC1HDAC3HDAC8HDAC2HDAC4
SCHEMBL3384155 0.83 HDAC1 (0.72) L3MBTL1LMNAMAPTTDP1HDAC1
SCHEMBL7096384 0.83 HDAC1 (0.49) LMNAHDAC1HDAC3NPC1RAB9A
SCHEMBL7093746 0.81 MARS1 (0.50) L3MBTL1LMNAHDAC1HDAC3NPC1
SCHEMBL3161283 0.80 EPHX1 (0.66) L3MBTL1MARS1
SCHEMBL8778001 0.80 EPHX1 (0.66) L3MBTL1MARS1
SCHEMBL8600552 0.80 EPHX1 (0.66) L3MBTL1MARS1
SCHEMBL8389275 0.80 EPHX1 (0.66) L3MBTL1MARS1
SCHEMBL8597850 0.80 EPHX1 (0.66) L3MBTL1MARS1

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
US-20090181971-A1 Inhibitors of Histone Deacetylase METHYLGENE INC. 2009-07-16 US disclosed
US-20090181971-A1 Inhibitors of Histone Deacetylase METHYLGENE INC. 2009-07-16 US disclosed
US-7288567-B2 Inhibitors of histone deacetylase METHYLGENE INC. (CA) 2007-10-30 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-20090181971-A1 Inhibitors of Histone Deacetylase HDAC1, HDAC5, HDAC3 L3MBTL1 1291/4885LMNA 1922/4885MAPT 2110/4885

“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.