SCHEMBL29549489

SCHEMBL29549489

CC(C)(C)OC(=O)Nc1cc(F)ccc1N

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 13/20 0.50
HDAC2 Q92769 12/20 0.49
AAK1 Q2M2I8 1/20 0.46
KCNQ4 P56696 1/20 0.45
KCNQ5 Q9NR82 1/20 0.45
HDAC3 O15379 5/20 0.42
CYP17A1 P05093 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41

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
SCHEMBL826795 1.00 HDAC1 (0.50) HDAC1HDAC2AAK1KCNQ4KCNQ5
SCHEMBL29581478 0.88 HDAC1 (0.55) HDAC1HDAC2AAK1KCNQ4KCNQ5
SCHEMBL197145 0.88 HDAC1 (0.55) HDAC1HDAC2AAK1KCNQ4KCNQ5
SCHEMBL30926421 0.87 HDAC2 (0.42) HDAC1HDAC2AAK1KCNQ4KCNQ5
SCHEMBL3407965 0.84 HPGD (0.49) HDAC1HDAC2AAK1HDAC3
SCHEMBL29741562 0.84 HPGD (0.49) HDAC1HDAC2AAK1HDAC3
SCHEMBL15614546 0.84 MAPT (0.51) KCNQ4KCNQ5CYP17A1RXFP1
SCHEMBL2227781 0.84 AAK1 (0.48) HDAC1HDAC2AAK1HDAC3RXFP1
SCHEMBL20057682 0.83 AAK1 (0.47) HDAC1HDAC2AAK1HDAC3RXFP1
SCHEMBL27398698 0.83 MAPT (0.51) KCNQ4KCNQ5RXFP1

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
EP-4631931-A1 HDAC INHIBITOR AND USE THEREOF Wigen Biomedicine Technology (Shanghai) Co., Ltd. (CN) 2025-10-15 EP disclosed
US-12365664-B2 Small molecule inhibitors of SRC tyrosine kinase DANA-FARBER CANCER INSTITUTE, INC. (US) 2025-07-22 US disclosed
WO-2025041160-A1 BIFUNCTIONAL CONJUGATE MOLECULES FOR CANCER TREATMENT AND PROCESS OF MAKING THE SAME BIRLA INSTITUTE OF TECHNOLOGY AND SCIENCE (BITS), PILANI (IN) 2025-02-27 WO disclosed
EP-4093730-B1 HDAC DEGRADER UNIV LEICESTER (GB) 2024-05-08 EP disclosed
US-20230120211-A1 HDAC Degrader UNIVERSITY OF LEICESTER (GB) 2023-04-20 US disclosed
EP-4093730-A1 HDAC DEGRADER University of Leicester (GB) 2022-11-30 EP disclosed
US-20220267294-A1 SMALL MOLECULE INHIBITORS OF SRC TYROSINE KINASE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2022-08-25 US disclosed
EP-3986411-A1 SMALL MOLECULE INHIBITORS OF SRC TYROSINE KINASE Dana-Farber Cancer Institute, Inc. (US) 2022-04-27 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 (3 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-12365664-B2 Small molecule inhibitors of SRC tyrosine kinase SRC, CTTN, LCK HDAC1 594/4885HDAC2 1033/4885AAK1 890/4885
US-20230120211-A1 HDAC Degrader HDAC1, HDAC11, HDAC3 HDAC1 1/4885HDAC2 4/4885AAK1 3875/4885
US-20220267294-A1 SMALL MOLECULE INHIBITORS OF SRC TYROSINE KINASE SRC, CTTN, LCK HDAC1 594/4885HDAC2 1033/4885AAK1 890/4885

“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.