SCHEMBL6038205

SCHEMBL6038205

O=C1c2ccccc2C(=O)N1CCCCCn1cc(-c2ccccc2)nn1

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 2/20 0.60
HSP90AB1 P08238 2/20 0.59
HDAC8 Q9BY41 11/20 0.58
HDAC6 Q9UBN7 10/20 0.58
HDAC2 Q92769 9/20 0.58
HDAC3 O15379 8/20 0.58
HDAC4 P56524 8/20 0.58
HDAC1 Q13547 8/20 0.58
HDAC7 Q8WUI4 8/20 0.58
HDAC10 Q969S8 8/20 0.58
HDAC11 Q96DB2 8/20 0.58
HDAC9 Q9UKV0 8/20 0.58
HDAC5 Q9UQL6 8/20 0.58
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
TDP1 Q9NUW8 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51

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
SCHEMBL19086277 0.85 HSP90AB1 (0.52) NAMPTHSP90AB1HDAC8HDAC6HDAC2
SCHEMBL16068261 0.81 KEAP1 (0.53) NAMPTHSP90AB1MEN1KMT2A
SCHEMBL5287307 0.79 HDAC8 (0.61) NAMPTHDAC8HDAC6HDAC2HDAC3
SCHEMBL2189376 0.79 HDAC8 (0.61) NAMPTHDAC8HDAC6HDAC2HDAC3
SCHEMBL16271201 0.79 HDAC8 (0.61) NAMPTHDAC8HDAC6HDAC2HDAC3
SCHEMBL4224259 0.79 HDAC8 (0.61) NAMPTHDAC8HDAC6HDAC2HDAC3
SCHEMBL27794495 0.79 HDAC8 (0.61) NAMPTHDAC8HDAC6HDAC2HDAC3
SCHEMBL16212709 0.78 NAMPT (0.83) NAMPTHDAC8HDAC6HDAC2HDAC3
SCHEMBL19851582 0.78 HDAC8 (0.76) HDAC8HDAC6HDAC2HDAC3HDAC4
SCHEMBL16212873 0.78 NAMPT (0.83) NAMPTHDAC8HDAC6HDAC2HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060264415-A1 Inhibitors of histone deacetylase METHYLGENE INC. 2006-11-23 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-20060264415-A1 Inhibitors of histone deacetylase HDAC1, HDAC3, HDAC11 NAMPT 1262/4885HSP90AB1 2055/4885HDAC8 11/4885

“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.