SCHEMBL18585136

SCHEMBL18585136

CC(C)(C)OC(=O)Nc1ccc(-c2cc(C(=O)NCc3ccc(C(=O)NO)cc3)no2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 9/20 1.00
HDAC1 Q13547 8/20 1.00
HDAC3 O15379 6/20 0.72
HDAC10 Q969S8 5/20 0.72
HDAC2 Q92769 5/20 0.66
HDAC8 Q9BY41 5/20 0.66
HDAC4 P56524 2/20 0.65
HDAC7 Q8WUI4 2/20 0.65
HDAC11 Q96DB2 2/20 0.65
HDAC9 Q9UKV0 2/20 0.65
HDAC5 Q9UQL6 2/20 0.65
MAPT P10636 3/20 0.56
POLB P06746 1/20 0.52
TP53 P04637 1/20 0.49
LMNA P02545 1/20 0.48
HPGD P15428 2/20 0.48
HSD17B10 Q99714 2/20 0.48
ALDH1A1 P00352 1/20 0.48
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47

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
SCHEMBL18585451 0.90 HDAC6 (0.82) HDAC6HDAC1HDAC3HDAC10HDAC2
SCHEMBL18585376 0.81 HDAC6 (1.00) HDAC6HDAC1HDAC3HDAC10HDAC2
SCHEMBL18619856 0.79 HDAC6 (0.65) HDAC6HDAC1HDAC3HDAC10HDAC2
SCHEMBL21661941 0.79 HDAC6 (0.63) HDAC6HDAC1HDAC3HDAC8LMNA
SCHEMBL1932723 0.79 HDAC1 (1.00) HDAC6HDAC1HDAC3HDAC10HDAC2
SCHEMBL18585040 0.79 HDAC6 (0.65) HDAC6HDAC1HDAC3HDAC10HDAC2
SCHEMBL28192538 0.77 HDAC1 (0.65) HDAC6HDAC1HDAC3HDAC10HDAC2
SCHEMBL18585378 0.76 HDAC1 (0.67) HDAC6HDAC1HDAC3HDAC10HDAC2
SCHEMBL22919091 0.75 HDAC1 (0.59) HDAC6HDAC1HDAC3HDAC10HDAC2
SCHEMBL23898954 0.74 HDAC1 (0.59) HDAC6HDAC1MAPTALDH1A1NAMPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11739064-B2 HDAC inhibitors and therapeutic methods using the same THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2023-08-29 US disclosed
US-11739064-B2 HDAC inhibitors and therapeutic methods using the same THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2023-08-29 US disclosed
US-20210139438-A1 HDAC Inhibitors and Therapeutic Methods Using the Same NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2021-05-13 US disclosed
US-20210139438-A1 HDAC Inhibitors and Therapeutic Methods Using the Same NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2021-05-13 US disclosed
US-10836733-B2 HDAC inhibitors and therapeutic methods using the same THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2020-11-17 US disclosed
US-10836733-B2 HDAC inhibitors and therapeutic methods using the same THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2020-11-17 US disclosed
US-20190023670-A1 HDAC Inhibitors and Therapeutic Methods Using the Same NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2019-01-24 US disclosed
US-20190023670-A1 HDAC Inhibitors and Therapeutic Methods Using the Same NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2019-01-24 US disclosed
WO-2017040564-A1 HDAC INHIBITORS AND THERAPEUTIC METHODS USING THE SAME THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2017-03-09 WO disclosed
WO-2017040564-A1 HDAC INHIBITORS AND THERAPEUTIC METHODS USING THE SAME THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2017-03-09 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 (4 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-20190023670-A1 HDAC Inhibitors and Therapeutic Methods Using the Same HDAC1, HDAC9, HDAC8 HDAC6 9/4885HDAC1 1/4885HDAC3 10/4885
US-20210139438-A1 HDAC Inhibitors and Therapeutic Methods Using the Same HDAC1, HDAC9, HDAC8 HDAC6 9/4885HDAC1 1/4885HDAC3 10/4885
US-11739064-B2 HDAC inhibitors and therapeutic methods using the same HDAC1, HDAC9, HDAC8 HDAC6 9/4885HDAC1 1/4885HDAC3 10/4885
US-10836733-B2 HDAC inhibitors and therapeutic methods using the same HDAC1, HDAC9, HDAC8 HDAC6 9/4885HDAC1 1/4885HDAC3 10/4885

“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.