SCHEMBL5943921

SCHEMBL5943921

CC(C)c1ccc(C(=O)NO)cc1

nearest known ligand 0.71

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 13/20 0.71
HDAC1 Q13547 10/20 0.71
HDAC8 Q9BY41 7/20 0.71
HDAC2 Q92769 4/20 0.59
HDAC3 O15379 3/20 0.55
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
MEN1 O00255 1/20 0.53
RAB9A P51151 1/20 0.53
KMT2A Q03164 1/20 0.53
SMN1; SMN2 Q16637 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
SCHEMBL21628436 0.89 HDAC6 (0.59) HDAC6HDAC1HDAC8HDAC2HDAC3
SCHEMBL4658281 0.83 HDAC1 (0.56) HDAC6HDAC1HDAC8SMN1; SMN2
SCHEMBL4657316 0.83 HDAC1 (0.56) HDAC6HDAC1HDAC8SMN1; SMN2
SCHEMBL24931337 0.83 HDAC1 (0.72) HDAC6HDAC1HDAC8HDAC2HDAC3
SCHEMBL105171 0.83 HDAC6 (0.59) HDAC6HDAC1HDAC8HDAC2CA2
SCHEMBL21146978 0.82 HDAC1 (0.65) HDAC6HDAC1HDAC8HDAC2HDAC3
SCHEMBL15480536 0.81 HDAC8 (0.68) HDAC6HDAC1HDAC8HDAC3MEN1
SCHEMBL2412211 0.81 HDAC6 (0.50) HDAC6HDAC1HDAC8HDAC2HDAC3
SCHEMBL624339 0.81 KDM4E (0.61) HDAC6HDAC1HDAC8HDAC2HDAC3
SCHEMBL104474 0.81 MLYCD (0.59) HDAC6HDAC1HDAC8MEN1RAB9A

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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11723362-B2 Broad-spectrum synergistic antimicrobial compositions -The United States of America, as represented by The Secretary of Agriculture (US) 2023-08-15 US disclosed
EP-4030915-A1 BROAD-SPECTRUM SYNERGISTIC ANTIMICROBIAL COMPOSITIONS The United States of America as represented by the Secretary of Agriculture (US) 2022-07-27 EP disclosed
US-20210084896-A1 BROAD-SPECTRUM SYNERGISTIC ANTIMICROBIAL COMPOSITIONS METHOD PRODUCTS, PBC, 2021-03-25 US disclosed
WO-2021055720-A1 BROAD-SPECTRUM SYNERGISTIC ANTIMICROBIAL COMPOSITIONS THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 2021-03-25 WO disclosed
US-20200276180-A1 POLYCYCLIC COMPOUND ACTING AS IDO INHIBITOR AND/OR IDO-HDAC DUAL INHIBITOR HANGZHOU INNOGATE PHARMA CO., LTD (CN) 2020-09-03 US disclosed
EP-3686196-A1 POLYCYCLIC COMPOUND ACTING AS IDO INHIBITOR AND/OR IDO-HDAC DUAL INHIBITOR Hangzhou Innogate Pharma Co., Ltd. (CN) 2020-07-29 EP disclosed
US-20200165257-A1 INHIBITORS OF PHOSPHOINOSITIDE 3-KINASE AND HISTONE DEACETYLASE FOR TREATMENT OF CANCER THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES 2020-05-28 US disclosed
US-9969987-B2 Split peroxidases and methods of use MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2018-05-15 US disclosed
US-9969987-B2 Split peroxidases and methods of use MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2018-05-15 US disclosed
US-9714240-B2 Vinyl autotaxin inhibitor compounds PHARMAKEA, INC. (US) 2017-07-25 US disclosed
US-20140206013-A1 SPLIT PEROXIDASES AND METHODS OF USE MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2014-07-24 US disclosed
US-20140186870-A1 IN VIVO PROTEOMICS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2014-07-03 US disclosed
WO-2013059582-A2 SMALL MOLECULE INHIBITORS OF HISTONE DEACTEYLASES NUPOTENTIAL, INC. (US) 2013-04-25 WO disclosed
WO-2012174479-A1 IN VIVO PROTEOMICS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2012-12-20 WO disclosed
WO-2011106632-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-09-01 WO disclosed
US-20060058553-A1 Novel bicyclic hydroxamates as inhibitors of histone deacetylase AXYS PHARMACEUTICALS, INC. (US) 2006-03-16 US disclosed
EP-1472216-A2 NOVEL BICYCLIC HYDROXAMATES AS INHIBITORS OF HISTONE DEACETYLASE Axys Pharmaceuticals (US) 2004-11-03 EP disclosed
WO-2003066579-A2 NOVEL BICYCLIC HYDROXAMATES AS INHIBITORS OF HISTONE DEACETYLASE AXYS PHARMACEUTICALS (US) 2003-08-14 WO disclosed
EP-0388389-A2 Improved detergent compositions MONSANTO EUROPE S.A./N.V. (BE) 1990-09-19 EP disclosed
EP-0384912-A2 Hydroxamate bleach stabilizer MONSANTO COMPANY (US) 1990-08-29 EP 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 (5 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-20200165257-A1 INHIBITORS OF PHOSPHOINOSITIDE 3-KINASE AND HISTONE DEACETYLASE FOR TREATMENT OF CANCER HDAC1, HDAC3, HDAC4 HDAC6 10/4885HDAC1 1/4885HDAC8 6/4885
US-11723362-B2 Broad-spectrum synergistic antimicrobial compositions HAO2, CAT, NACA HDAC6 57/4885HDAC1 536/4885HDAC8 539/4885
US-20200276180-A1 POLYCYCLIC COMPOUND ACTING AS IDO INHIBITOR AND/OR IDO-HDAC DUAL INHIBITOR IDO1, HDAC1, HDAC2 HDAC6 9/4885HDAC1 2/4885HDAC8 15/4885
US-20210084896-A1 BROAD-SPECTRUM SYNERGISTIC ANTIMICROBIAL COMPOSITIONS HAO2, CAT, NACA HDAC6 57/4885HDAC1 536/4885HDAC8 539/4885
US-20060058553-A1 Novel bicyclic hydroxamates as inhibitors of histone deacetylase HDAC1, HDAC2, HDAC11 HDAC6 11/4885HDAC1 1/4885HDAC8 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.