SCHEMBL4291981

SCHEMBL4291981

CCCCN(C)Cc1cccc(-c2ccccc2S(=O)(=O)N2CCN(c3ncc(C(=O)NO)s3)CC2)c1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HDAC2 Q92769 14/20 0.52
HDAC3 O15379 13/20 0.52
HDAC4 P56524 13/20 0.52
HDAC1 Q13547 13/20 0.52
HDAC7 Q8WUI4 13/20 0.52
HDAC10 Q969S8 13/20 0.52
HDAC11 Q96DB2 13/20 0.52
HDAC8 Q9BY41 13/20 0.52
HDAC6 Q9UBN7 13/20 0.52
HDAC9 Q9UKV0 13/20 0.52
HDAC5 Q9UQL6 13/20 0.52
SNCA P37840 4/20 0.39
CYP1A2 P05177 1/20 0.38
POLB P06746 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C19 P33261 1/20 0.38

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
SCHEMBL4293094 0.93 HDAC2 (0.53) HDAC2HDAC3HDAC4HDAC1HDAC7
SCHEMBL4288498 0.93 HDAC2 (0.53) HDAC2HDAC3HDAC4HDAC1HDAC7
SCHEMBL4292413 0.91 HDAC6 (0.52) HDAC2HDAC3HDAC4HDAC1HDAC7
SCHEMBL4169333 0.86 HDAC2 (0.55) HDAC2HDAC3HDAC4HDAC1HDAC7
SCHEMBL4175980 0.84 HDAC2 (0.58) HDAC2HDAC3HDAC4HDAC1HDAC7
SCHEMBL5353081 0.84 HDAC2 (0.57) HDAC2HDAC3HDAC4HDAC1HDAC7
SCHEMBL4293325 0.83 HDAC2 (0.56) HDAC2HDAC3HDAC4HDAC1HDAC7
SCHEMBL4020428 0.83 HDAC2 (0.60) HDAC2HDAC3HDAC4HDAC1HDAC7
SCHEMBL4016976 0.80 HDAC2 (0.55) HDAC2HDAC3HDAC4HDAC1HDAC7
SCHEMBL4288115 0.79 HDAC2 (0.53) HDAC2HDAC3HDAC4HDAC1HDAC7

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-20050250784-A1 Inhibitors of histone deacetylase MIIKANA THERAPEUTICS CORPORATION 2005-11-10 US claimed
US-20090203010-A1 MSMB-gene based diagnosis, staging and prognosis of prostate cancer KATHOLIEKE UNIVERSITEIT LEUVEN, K.U. LEUVEN R&D (BE) 2009-08-13 US disclosed
US-20050250784-A1 Inhibitors of histone deacetylase MIIKANA THERAPEUTICS CORPORATION 2005-11-10 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-20050250784-A1 Inhibitors of histone deacetylase HDAC1, HDAC11, HDAC10 HDAC2 5/4885HDAC3 6/4885HDAC4 11/4885
US-20090203010-A1 MSMB-gene based diagnosis, staging and prognosis of prostate cancer MAT2B, DNMT3B, SHBG HDAC2 3643/4885HDAC3 3834/4885HDAC4 2788/4885

“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.