SCHEMBL13159743

SCHEMBL13159743

O=C(CCCCCC(C(=O)NCc1ccccc1)C(=O)NCc1ccccc1)NO

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MMP8 P22894 2/20 0.62
▸ MEN1 O00255 1/20 0.60
▸ KMT2A Q03164 1/20 0.60
▸ HDAC1 Q13547 8/20 0.59
▸ HDAC2 Q92769 7/20 0.59
▸ HDAC3 O15379 5/20 0.59
▸ HDAC8 Q9BY41 5/20 0.59
▸ NCOR2 Q9Y618 4/20 0.59
▸ ALOX5 P09917 1/20 0.57
▸ HDAC6 Q9UBN7 2/20 0.56
▸ HDAC10 Q969S8 1/20 0.56
▸ HDAC11 Q96DB2 1/20 0.56
▸ GAA P10253 1/20 0.54
▸ EPHX2 P34913 1/20 0.54
▸ HDAC5 Q9UQL6 1/20 0.53

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
SCHEMBL13159744 0.86 HDAC1 (0.72) MMP8HDAC1HDAC2HDAC3HDAC8
SCHEMBL8082660 0.84 MEN1 (0.86) MEN1KMT2AHDAC1HDAC2HDAC3
SCHEMBL8312047 0.81 HDAC1 (0.70) MEN1KMT2AHDAC1HDAC2HDAC3
SCHEMBL13928115 0.81 HDAC1 (0.70) MEN1KMT2AHDAC1HDAC2HDAC3
SCHEMBL8296132 0.81 MMP8 (0.70) MMP8EPHX2
SCHEMBL30199483 0.80 MMP1 (0.66) HDAC1HDAC2HDAC3HDAC8HDAC6
SCHEMBL8200430 0.80 HDAC2 (0.77) HDAC1HDAC2HDAC3HDAC8NCOR2
SCHEMBL13928112 0.80 HDAC1 (0.62) HDAC1HDAC2HDAC3HDAC8NCOR2
SCHEMBL8312589 0.80 HDAC1 (0.62) HDAC1HDAC2HDAC3HDAC8NCOR2
SCHEMBL13786403 0.78 MEN1 (0.66) MEN1KMT2AHDAC1HDAC2HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7799803-B2 Hydroxamic acid compounds and methods of use thereof THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2010-09-21 — — US disclosed
US-7799803-B2 Hydroxamic acid compounds and methods of use thereof THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2010-09-21 — — US disclosed
US-20070155785-A1 Hydroxamic acid compounds and methods of use thereof NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2007-07-05 — — US disclosed
US-20070155785-A1 Hydroxamic acid compounds and methods of use thereof NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2007-07-05 — — US disclosed
US-7199134-B2 Hydroxamic acid compounds and methods of use thereof SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2007-04-03 — — US disclosed
US-7199134-B2 Hydroxamic acid compounds and methods of use thereof SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2007-04-03 — — 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 (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-20070155785-A1 Hydroxamic acid compounds and methods of use thereof HDAC5, BRDT, HDAC1 MMP8 1006/4885MEN1 2750/4885KMT2A 78/4885

“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.

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