SCHEMBL15565003

SCHEMBL15565003

CCC(=O)CCCCCC(NC(=O)Cc1c(C)[nH]c2ccc(OC)cc12)c1ncc(-c2cc3ccccc3nc2OC)o1

nearest known ligand 0.78

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 19/20 0.78
HDAC3 O15379 14/20 0.78
HDAC2 Q92769 14/20 0.78
HDAC6 Q9UBN7 13/20 0.78
HDAC8 Q9BY41 12/20 0.78
HDAC4 P56524 9/20 0.78
HDAC7 Q8WUI4 9/20 0.78
HDAC10 Q969S8 9/20 0.78
HDAC11 Q96DB2 9/20 0.78
HDAC9 Q9UKV0 9/20 0.78
HDAC5 Q9UQL6 9/20 0.78
KCNH2 Q12809 3/20 0.63

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
SCHEMBL15565002 1.00 HDAC1 (0.78) HDAC1HDAC3HDAC2HDAC6HDAC8
SCHEMBL15563877 0.93 HDAC1 (0.76) HDAC1HDAC3HDAC2HDAC6HDAC8
SCHEMBL15564032 0.89 HDAC1 (0.65) HDAC1HDAC3HDAC2HDAC6HDAC8
SCHEMBL15564031 0.89 HDAC1 (0.65) HDAC1HDAC3HDAC2HDAC6HDAC8
SCHEMBL2073548 0.88 HDAC1 (1.00) HDAC1HDAC3HDAC2HDAC6HDAC8
SCHEMBL15564456 0.88 HDAC1 (0.60) HDAC1HDAC3HDAC2HDAC6HDAC8
SCHEMBL15564458 0.88 HDAC1 (0.60) HDAC1HDAC3HDAC2HDAC6HDAC8
SCHEMBL15606556 0.87 HDAC1 (0.87) HDAC1HDAC3HDAC2HDAC6HDAC8
SCHEMBL16968865 0.87 HDAC1 (0.87) HDAC1HDAC3HDAC2HDAC6HDAC8
SCHEMBL15563435 0.84 HDAC2 (0.77) HDAC1HDAC3HDAC2HDAC6HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9371295-B2 Compounds for use in the treatment of disorders that are ameliorated by inhibition of HDAC IRBM-SCIENCE PARK S.P.A. (IT) 2016-06-21 US claimed
US-20150218112-A1 COMPOUNDS FOR USE IN THE TREATMENT OF DISORDERS THAT ARE AMELIORATED BY INHIBITION OF HDAC IRBM - SCIENCE PARK S.P.A. (IT) 2015-08-06 US claimed
EP-2882724-B1 COMPOUNDS FOR USE IN THE TREATMENT OF DISORDERS THAT ARE AMELIORATED BY INHIBITION OF HDAC IRBM - SCIENCE PARK S P A (IT) 2017-11-01 EP disclosed
EP-2882724-B1 COMPOUNDS FOR USE IN THE TREATMENT OF DISORDERS THAT ARE AMELIORATED BY INHIBITION OF HDAC IRBM - SCIENCE PARK S P A (IT) 2017-11-01 EP disclosed
US-9371295-B2 Compounds for use in the treatment of disorders that are ameliorated by inhibition of HDAC IRBM-SCIENCE PARK S.P.A. (IT) 2016-06-21 US disclosed
US-20150218112-A1 COMPOUNDS FOR USE IN THE TREATMENT OF DISORDERS THAT ARE AMELIORATED BY INHIBITION OF HDAC IRBM - SCIENCE PARK S.P.A. (IT) 2015-08-06 US disclosed
EP-2882724-A1 COMPOUNDS FOR USE IN THE TREATMENT OF DISORDERS THAT ARE AMELIORATED BY INHIBITION OF HDAC IRBM - Science Park S.p.A. (IT) 2015-06-17 EP disclosed
WO-2014023754-A1 COMPOUNDS FOR USE IN THE TREATMENT OF DISORDERS THAT ARE AMELIORATED BY INHIBITION OF HDAC IRBM - SCIENCE PARK S.P.A. (IT) 2014-02-13 WO 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-20150218112-A1 COMPOUNDS FOR USE IN THE TREATMENT OF DISORDERS THAT ARE AMELIORATED BY INHIBITION OF HDAC HDAC5, HDAC4, HDAC6 HDAC1 5/4885HDAC3 7/4885HDAC2 12/4885

“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.