SCHEMBL10247072

SCHEMBL10247072

Cc1ccc(C2CCc3cc(C(=O)NO)ccc3C2)cc1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 12/20 0.48
HDAC6 Q9UBN7 13/20 0.48
HDAC1 Q13547 2/20 0.48
HDAC3 O15379 1/20 0.44
HDAC11 Q96DB2 1/20 0.44
MCHR1 Q99705 1/20 0.43

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
SCHEMBL10246916 0.87 HDAC8 (0.56) HDAC8HDAC6HDAC1HDAC3HDAC11
SCHEMBL10246917 0.87 HDAC6 (0.51) HDAC8HDAC6HDAC1
SCHEMBL355341 0.86 CA1 (0.51) HDAC8HDAC6HDAC1MCHR1
SCHEMBL10249752 0.85 HDAC8 (0.51) HDAC8HDAC6HDAC1
SCHEMBL10249977 0.85 TDP1 (0.47) MCHR1
SCHEMBL10283440 0.84 HDAC6 (0.52) HDAC8HDAC6HDAC1HDAC3HDAC11
SCHEMBL10247172 0.83 HDAC6 (0.47) HDAC8HDAC6HDAC1HDAC3MCHR1
SCHEMBL10249746 0.82 HDAC8 (0.61) HDAC8HDAC6HDAC1
SCHEMBL10254320 0.82 HDAC6 (0.43) HDAC8HDAC6HDAC1
SCHEMBL10247009 0.82 HDAC8 (0.57) HDAC8HDAC6HDAC1

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-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

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 1/4885HDAC1 2/4885
US-20140243335-A1 SUBSTITUTED HYDOXAMIC ACIDS AND USES THEREOF HDAC6, HDAC1, H1-3 HDAC8 20/4885HDAC6 1/4885HDAC1 2/4885

“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.