SCHEMBL2403036

SCHEMBL2403036

COC(=O)c1ccc(CNC23CC4CC(CC(C4)C2)C3)cc1

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 2/20 0.68
ALDH1A1 P00352 3/20 0.59
LMNA P02545 2/20 0.59
EPHX2 P34913 7/20 0.58
CNR2 P34972 2/20 0.55
LOXL2 Q9Y4K0 1/20 0.51
HDAC8 Q9BY41 1/20 0.50
EPHX1 P07099 2/20 0.48
MAPT P10636 2/20 0.48
NPSR1 Q6W5P4 2/20 0.48
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.47
HPGD P15428 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
MAPK1 P28482 1/20 0.46

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
SCHEMBL22441219 0.94 HDAC6 (0.59) HDAC6ALDH1A1LMNAEPHX2CNR2
SCHEMBL1421044 0.88 HDAC6 (0.64) HDAC6ALDH1A1LMNAEPHX2CNR2
SCHEMBL24419731 0.86 EPHX2 (0.55) HDAC6ALDH1A1LMNAEPHX2CNR2
SCHEMBL15029019 0.85 HDAC6 (0.72) HDAC6ALDH1A1LMNAEPHX2CNR2
SCHEMBL16884347 0.84 HDAC6 (0.56) HDAC6ALDH1A1LMNAEPHX2CNR2
SCHEMBL15009111 0.84 HDAC6 (0.50) HDAC6ALDH1A1LMNAEPHX2CNR2
SCHEMBL1421158 0.84 HDAC6 (0.74) HDAC6ALDH1A1LMNAEPHX2CNR2
SCHEMBL15029094 0.82 HDAC6 (0.72) HDAC6ALDH1A1LMNAEPHX2CNR2
SCHEMBL21712145 0.81 HDAC6 (1.00) HDAC6CNR2HDAC8KMT2AMEN1
SCHEMBL18423583 0.81 HDAC6 (0.70) HDAC6ALDH1A1LMNAEPHX2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12472271-B2 HDAC6 inhibitors and imaging agents THE GENERAL HOSPITAL CORPORATION (US) 2025-11-18 US disclosed
EP-3931183-B1 COMPOUNDS WITH FERROPTOSIS INDUCING ACTIVITY AND METHODS OF THEIR USE FERRO THERAPEUTICS INC (US) 2025-02-12 EP disclosed
EP-4397656-A2 HDAC6 INHIBITORS AND IMAGING AGENTS The General Hospital Corporation (US) 2024-07-10 EP disclosed
US-20240148915-A1 HDAC6 Inhibitors and Imaging Agents THE GENERAL HOSPITAL CORPORATION 2024-05-09 US disclosed
EP-3609864-B1 HDAC6 INHIBITORS AND IMAGING AGENTS MASSACHUSETTS GEN HOSPITAL (US) 2024-03-13 EP disclosed
US-11890356-B2 HDAC6 inhibitors and imaging agents THE GENERAL HOSPITAL CORPORATION (US) 2024-02-06 US disclosed
US-20220133916-A1 HDAC6 Inhibitors and Imaging Agents THE GENERAL HOSPITAL CORPORATION 2022-05-05 US disclosed
US-20220133916-A1 HDAC6 Inhibitors and Imaging Agents THE GENERAL HOSPITAL CORPORATION 2022-05-05 US disclosed
CN-114008024-A Compounds having iron death inducing activity and methods of using the same 费罗治疗公司 2022-02-01 CN disclosed
US-20220002280-A1 COMPOUNDS AND METHODS OF USE FERRO THERAPEUTICS INC (US) 2022-01-06 US disclosed
US-20160083355-A1 COMPOUNDS WHICH HAVE A PROTECTIVE ACTIVITY WITH RESPECT TO THE ACTION OF TOXINS AND OF VIRUSES WITH AN INTRACELLULAR MODE OF ACTION COMMISSARIAT ENERGIE ATOMIQUE (FR) 2016-03-24 US disclosed
US-20150191439-A1 INHIBITORS TARGETING DRUG-RESISTANT INFLUENZA A NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-07-09 US disclosed
WO-2013086131-A1 INHIBITORS TARGETING DRUG-RESISTANT INFLUENZA A THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2013-06-13 WO disclosed
US-20120283249-A1 Novel compounds which have a protective activity with respect to the action of toxins and of viruses with an intracellular mode of action COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2012-11-08 US disclosed
US-20120283249-A1 Novel compounds which have a protective activity with respect to the action of toxins and of viruses with an intracellular mode of action COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2012-11-08 US disclosed
US-20110212943-A1 NOVEL BRIDGED CYCLIC COMPOUNDS AS HISTONE DEACETYLASE INHIBITORS ORCHID RESEARCH LABORATORIES LIMITED (IN) 2011-09-01 US disclosed
US-20110212943-A1 NOVEL BRIDGED CYCLIC COMPOUNDS AS HISTONE DEACETYLASE INHIBITORS ORCHID RESEARCH LABORATORIES LIMITED (IN) 2011-09-01 US disclosed
US-20110212943-A1 NOVEL BRIDGED CYCLIC COMPOUNDS AS HISTONE DEACETYLASE INHIBITORS ORCHID RESEARCH LABORATORIES LIMITED (IN) 2011-09-01 US disclosed
WO-2010043953-A2 NOVEL BRIDGED CYCLIC COMPOUNDS AS HISTONE DEACETYLASE INHIBITORS ORCHID RESEARCH LABORATORIES LTD. (IN) 2010-04-22 WO disclosed
WO-2010043953-A2 NOVEL BRIDGED CYCLIC COMPOUNDS AS HISTONE DEACETYLASE INHIBITORS ORCHID RESEARCH LABORATORIES LTD. (IN) 2010-04-22 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 (9 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-20120283249-A1 Novel compounds which have a protective activity with respect to the action of toxins and of viruses with an intracellular mode of action HAVCR2, MAVS, ANTXR2 HDAC6 1145/4885ALDH1A1 4453/4885LMNA 872/4885
US-20160083355-A1 COMPOUNDS WHICH HAVE A PROTECTIVE ACTIVITY WITH RESPECT TO THE ACTION OF TOXINS AND OF VIRUSES WITH AN INTRACELLULAR MODE OF ACTION HAVCR2, MAVS, ANTXR2 HDAC6 1240/4885ALDH1A1 4539/4885LMNA 705/4885
US-20150191439-A1 INHIBITORS TARGETING DRUG-RESISTANT INFLUENZA A HAVCR2, HDLBP, HSP90B1 HDAC6 581/4885ALDH1A1 3831/4885LMNA 1831/4885
US-20220002280-A1 COMPOUNDS AND METHODS OF USE AIFM2, GPX4, GPX1 HDAC6 510/4885ALDH1A1 1254/4885LMNA 2800/4885
US-20240148915-A1 HDAC6 Inhibitors and Imaging Agents HDAC1, HDAC6, HDAC11 HDAC6 2/4885ALDH1A1 2488/4885LMNA 1973/4885
US-20110212943-A1 NOVEL BRIDGED CYCLIC COMPOUNDS AS HISTONE DEACETYLASE INHIBITORS HDAC1, HDAC11, HDAC7 HDAC6 8/4885ALDH1A1 1442/4885LMNA 2309/4885
US-12472271-B2 HDAC6 inhibitors and imaging agents HDAC1, HDAC6, HDAC11 HDAC6 2/4885ALDH1A1 2488/4885LMNA 1973/4885
US-11890356-B2 HDAC6 inhibitors and imaging agents HDAC1, HDAC6, HDAC11 HDAC6 2/4885ALDH1A1 2488/4885LMNA 1973/4885
US-20220133916-A1 HDAC6 Inhibitors and Imaging Agents HDAC1, HDAC6, HDAC11 HDAC6 2/4885ALDH1A1 2488/4885LMNA 1973/4885

“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.