SCHEMBL1521407

SCHEMBL1521407

O=C(CCCCCC(=O)c1ccc(-c2ccc(Cl)cc2)cc1)NO

nearest known ligand 0.75

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 13/20 0.75
HDAC8 Q9BY41 12/20 0.75
HDAC3 O15379 2/20 0.62
HDAC4 P56524 2/20 0.62
HDAC7 Q8WUI4 2/20 0.62
HDAC2 Q92769 2/20 0.62
HDAC10 Q969S8 2/20 0.62
HDAC11 Q96DB2 2/20 0.62
HDAC6 Q9UBN7 2/20 0.62
HDAC9 Q9UKV0 2/20 0.62
HDAC5 Q9UQL6 2/20 0.62
MMP1 P03956 1/20 0.60

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
SCHEMBL6387831 1.00 HDAC1 (0.75) HDAC1HDAC8HDAC3HDAC4HDAC7
SCHEMBL6385961 0.95 HDAC1 (0.68) HDAC1HDAC8HDAC3HDAC4HDAC7
SCHEMBL3379612 0.86 HDAC1 (1.00) HDAC1HDAC8HDAC3HDAC4HDAC7
SCHEMBL1520838 0.86 HDAC1 (1.00) HDAC1HDAC8HDAC3HDAC4HDAC7
SCHEMBL14380499 0.84 HDAC8 (0.75) HDAC1HDAC8HDAC3HDAC4HDAC7
SCHEMBL13069859 0.84 HDAC1 (0.75) HDAC1HDAC8
SCHEMBL6384647 0.82 HDAC1 (0.92) HDAC1HDAC8HDAC3HDAC4HDAC7
SCHEMBL6386067 0.82 HDAC1 (0.92) HDAC1HDAC8HDAC3HDAC4HDAC7
SCHEMBL13670548 0.82 HDAC1 (0.50) HDAC1HDAC8HDAC3HDAC4HDAC7
SCHEMBL6389162 0.81 HDAC1 (0.51) HDAC1HDAC8HDAC3HDAC4HDAC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050119305-A1 Il-6 production inhibitors ONO PHARMACEUTICAL CO., LTD. (JP) 2005-06-02 US claimed
US-20160015693-A1 METHODS AND COMPOUNDS FOR PREVENTING AND TREATING A TUMOUR AGENCY SCIENCE TECH & RES (SG) 2016-01-21 US disclosed
US-8969313-B2 Methods and compounds for preventing and treating a tumour AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2015-03-03 US disclosed
US-20110053882-A1 METHODS AND COMPOUNDS FOR PREVENTING AND TREATING A TUMOUR AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2011-03-03 US disclosed
EP-2217240-A1 METHODS AND COMPOUNDS FOR PREVENTING AND TREATING A TUMOUR Agency for Science, Technology And Research (SG) 2010-08-18 EP disclosed
WO-2009058102-A1 METHODS AND COMPOUNDS FOR PREVENTING AND TREATING A TUMOUR AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2009-05-07 WO disclosed
US-20050119305-A1 Il-6 production inhibitors ONO PHARMACEUTICAL CO., LTD. (JP) 2005-06-02 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 (3 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-20110053882-A1 METHODS AND COMPOUNDS FOR PREVENTING AND TREATING A TUMOUR HDAC1, CCAR2, HDAC11 HDAC1 1/4885HDAC8 19/4885HDAC3 4/4885
US-20160015693-A1 METHODS AND COMPOUNDS FOR PREVENTING AND TREATING A TUMOUR HDAC1, HDAC11, CCAR2 HDAC1 1/4885HDAC8 15/4885HDAC3 4/4885
US-20050119305-A1 Il-6 production inhibitors IL6, IL6ST, PADI6 HDAC1 1343/4885HDAC8 1593/4885HDAC3 1988/4885

“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.