SCHEMBL413228

SCHEMBL413228

CNC(=O)C1CCCCC1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC8 Q9BY41 1/20 0.61
▸ HDAC6 Q9UBN7 1/20 0.61
▸ EPHX1 P07099 1/20 0.50
▸ CES2 O00748 1/20 0.50
▸ CES1 P23141 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ HSD17B10 Q99714 1/20 0.48
▸ NAAA Q02083 1/20 0.47
▸ TSHR P16473 2/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ HSD11B1 P28845 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ HTT P42858 1/20 0.45
▸ PTPN1 P18031 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ CHRNB2 P17787 2/20 0.45
▸ CHRNA4 P43681 2/20 0.45
▸ CHRNA7 P36544 1/20 0.45
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44

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
SCHEMBL1679607 1.00 HDAC8 (0.61) HDAC8HDAC6EPHX1CES2CES1
SCHEMBL1678569 1.00 HDAC8 (0.61) HDAC8HDAC6EPHX1CES2CES1
SCHEMBL6917808 1.00 HDAC8 (0.61) HDAC8HDAC6EPHX1CES2CES1
SCHEMBL13060381 1.00 HDAC8 (0.61) HDAC8HDAC6EPHX1CES2CES1
SCHEMBL18935496 1.00 HDAC8 (0.61) HDAC8HDAC6EPHX1CES2CES1
SCHEMBL24618011 1.00 HDAC8 (0.61) HDAC8HDAC6EPHX1CES2CES1
SCHEMBL18938465 1.00 HDAC8 (0.61) HDAC8HDAC6EPHX1CES2CES1
SCHEMBL18934846 1.00 HDAC8 (0.61) HDAC8HDAC6EPHX1CES2CES1
SCHEMBL21212072 1.00 HDAC8 (0.61) HDAC8HDAC6EPHX1CES2CES1
Hydrochloric Acid SCHEMBL7274485 0.97 HDAC8 (0.58) HDAC8HDAC6EPHX1CES2CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025043350-A1 TRIAZOLOPYRIDOPYRIMIDINE AND DIHYDROIMIDAZOPYRIDOPYRIMIDINE DERIVATIVES AS INHIBITORS OF THE GCN2 KINASE, COMPOSITIONS AND USES THEREOF ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2025-03-06 — — WO claimed
WO-2025043349-A1 PYRIMIDOPYRIDONE AND PTERIDONE DERIVATIVES AS INHIBITORS OF THE GCN2 KINASE, COMPOSITIONS AND USES THEREOF ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2025-03-06 — — WO claimed
US-20240424112-A1 TETRAHYDROISOQUINOLINE COMPOUNDS THAT ARE KEAP1 BINDERS. C4X DISCOVERY LIMITED (GB) 2024-12-26 — — US claimed
EP-4423079-A1 TETRAHYDROISOQUINOLINE COMPOUNDS THAT ARE KEAP1 BINDERS C4X Discovery Limited (GB) 2024-09-04 — — EP claimed
CN-118265709-A Tetrahydroisoquinoline compounds as KEAP1 binders 希四克斯探索有限公司 2024-06-28 — — CN claimed
CN-112752757-B Tyrosine amide derivatives as RHO-kinase inhibitors 奇斯药制品公司 2024-01-12 — — CN claimed
CN-116199747-A Lidamycin prodrug, preparation method and application thereof in preparation of antitumor drugs 中国医学科学院医药生物技术研究所 2023-06-02 — — CN claimed
WO-2023073364-A1 TETRAHYDROISOQUINOLINE COMPOUNDS THAT ARE KEAP1 BINDERS C4X DISCOVERY LIMITED (GB) 2023-05-04 — — WO claimed
EP-4149945-A1 SUBSTITUTED TRICYCLIC AMIDES, ANALOGUES THEREOF, AND METHODS USING SAME Arbutus Biopharma Corporation (CA) 2023-03-22 — — EP claimed
CN-115190762-A Novel substituted sulfonylurea and sulfonimidurea derivatives 兹杜斯生命科学有限公司 2022-10-14 — — CN claimed
WO-2008024746-A1 4-SUBSTITUTED PHENOXYPHENYLACETIC ACID DERIVATIVES ARRAY BIOPHARMA, INC. (US) 2008-02-28 — — WO claimed
CN-101031595-A One-component cationic palladium pre-initiator for the latent polymerization of cycloolefins PROMERUS LLC (US) 2007-09-05 — — CN claimed
EP-1773796-A2 OXOPIPERIDINE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF Sanofi-Aventis (FR) 2007-04-18 — — EP claimed
EP-1680218-A2 SINGLE COMPONENT CATIONIC PALLADIUM PROINITIATORS FOR THE LATENT POLYMERIZATION OF CYCLOOLEFINS Promerus, LLC (US) 2006-07-19 — — EP claimed
EP-1660507-A2 PROTEASOME INHIBITORS AND METHODS OF USING THE SAME CEPHALON, INC. (US) 2006-05-31 — — EP claimed
WO-2006021655-A2 OXOPIPERIDINE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2006-03-02 — — WO claimed
WO-2005042147-A2 SINGLE COMPONENT CATIONIC PALLADIUM PROINITIATORS FOR THE LATENT POLYMERIZATION OF CYCLOOLEFINS PROMERUS, LLC (US) 2005-05-12 — — WO claimed
WO-2005021558-A2 PROTEASOME INHIBITORS AND METHODS OF USING THE SAME CEPHALON, INC. (US) 2005-03-10 — — WO claimed
EP-1068187-A1 PYRAZOLE INHIBITORS OF CYTOKINE PRODUCTION ABBOTT LABORATORIES (US) 2001-01-17 — — EP claimed
WO-1999051580-A1 PYRAZOLE INHIBITORS OF CYTOKINE PRODUCTION ABBOTT LABORATORIES (US) 1999-10-14 — — WO claimed

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-20240424112-A1 TETRAHYDROISOQUINOLINE COMPOUNDS THAT ARE KEAP1 BINDERS. KEAP1, RBX1, CUL2 HDAC8 2195/4885HDAC6 453/4885EPHX1 1217/4885

“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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