SCHEMBL353250

SCHEMBL353250

CC(C)N1CCC(C)(C(=O)Nc2cc(C3CCc4cc(C(=O)NO)ccc4C3)ccn2)CC1

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 12/20 0.40
HDAC6 Q9UBN7 9/20 0.40
FGFR1 P11362 1/20 0.35
KMT2A Q03164 1/20 0.34
SLC5A7 Q9GZV3 1/20 0.34

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
SCHEMBL355886 0.92 HDAC8 (0.42) HDAC8HDAC6
SCHEMBL10247234 0.89 HDAC8 (0.40) HDAC8HDAC6FGFR1
SCHEMBL353539 0.87 HDAC8 (0.42) HDAC8HDAC6
SCHEMBL354799 0.85 NPC1 (0.38) HDAC8HDAC6KMT2ASLC5A7
SCHEMBL353143 0.85 HDAC8 (0.39) HDAC8HDAC6FGFR1KMT2ASLC5A7
SCHEMBL355739 0.83 HDAC8 (0.46) HDAC8HDAC6
SCHEMBL15969159 0.78 BRAF (0.48) HDAC8HDAC6
SCHEMBL356031 0.78 HRH3 (0.39) FGFR1KMT2ASLC5A7
SCHEMBL346726 0.78 GSK3B (0.41)
SCHEMBL353930 0.77 HDAC8 (0.54) HDAC8HDAC6

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
US-20140243335-A1 SUBSTITUTED HYDOXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2014-08-28 US disclosed
US-20140243335-A1 SUBSTITUTED HYDOXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2014-08-28 US disclosed
US-20120015943-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACUTICALS, INC. (US) 2012-01-19 US disclosed
US-20120015943-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACUTICALS, INC. (US) 2012-01-19 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 (2 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-20120015943-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF HDAC6, HDAC1, HDAC2 HDAC8 13/4885HDAC6 1/4885FGFR1 60/4885
US-20140243335-A1 SUBSTITUTED HYDOXAMIC ACIDS AND USES THEREOF HDAC6, HDAC1, H1-3 HDAC8 20/4885HDAC6 1/4885FGFR1 518/4885

“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.