SCHEMBL3926318

SCHEMBL3926318

O=C(/C=C/c1ccc(CS(=O)(=O)Nc2cccnc2)cc1)NO

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 7/20 0.67
HDAC8 Q9BY41 7/20 0.60
HDAC4 P56524 4/20 0.56
MEF2D Q14814 1/20 0.56
HDAC3 O15379 4/20 0.56
HDAC2 Q92769 4/20 0.56
HDAC6 Q9UBN7 4/20 0.56
HDAC7 Q8WUI4 3/20 0.56
HDAC10 Q969S8 3/20 0.56
HDAC11 Q96DB2 3/20 0.56
HDAC9 Q9UKV0 3/20 0.56
HDAC5 Q9UQL6 3/20 0.56
NPC1 O15118 3/20 0.52
RAB9A P51151 3/20 0.52
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
NAMPT P43490 3/20 0.48
POLB P06746 2/20 0.48
ALDH1A1 P00352 1/20 0.48
MAPT P10636 1/20 0.48

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
SCHEMBL3926321 1.00 HDAC1 (0.67) HDAC1HDAC8HDAC4MEF2DHDAC3
SCHEMBL21710759 0.85 HDAC1 (0.90) HDAC1HDAC8HDAC4MEF2DHDAC3
SCHEMBL3916969 0.84 HDAC8 (0.47) HDAC1HDAC8NPC1RAB9AMEN1
SCHEMBL1403586 0.80 HDAC1 (1.00) HDAC1HDAC8HDAC4HDAC3HDAC2
SCHEMBL1403584 0.80 HDAC1 (1.00) HDAC1HDAC8HDAC4HDAC3HDAC2
SCHEMBL3919498 0.79 SMN1; SMN2 (0.48) MEN1KMT2ANAMPTPOLBALDH1A1
SCHEMBL9568557 0.77 SMN1; SMN2 (0.58) KMT2ANAMPTALDH1A1SMN1; SMN2
SCHEMBL8254056 0.76 HDAC1 (0.77) HDAC1HDAC8HDAC4MEF2DHDAC3
SCHEMBL3917001 0.75 ALPL (0.57) NPC1RAB9ANAMPTPOLBALDH1A1
SCHEMBL5020623 0.75 HDAC1 (0.72) HDAC1HDAC8HDAC4HDAC3HDAC2

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-7495022-B2 α,β-unsaturated hydroxamic acid derivatives and their use as histone deacetylase inhibitors SK CHEMICALS CO., LTD. (KR) 2009-02-24 US disclosed
US-20050124679-A1 Alpha, beta-unsaturated hydroxamic acid derivatives and their use as histone deacetylase inhibitors SK CHEMICALS CO., LTD. (KR) 2005-06-09 US disclosed
WO-2003087066-A1 α,β-UNSATURATED HYDROXAMIC ACID DERIVATIVES AND THEIR USE AS HISTONE DEACETYLASE INHIBITORS SK CHEMICALS, CO., LTD. (KR) 2003-10-23 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-20050124679-A1 Alpha, beta-unsaturated hydroxamic acid derivatives and their use as histone deacetylase inhibitors HDAC1, HDAC5, HDAC9 HDAC1 1/4885HDAC8 5/4885HDAC4 9/4885

“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.