SCHEMBL418082

SCHEMBL418082

CCI.CCI.CCI.CCN(CC)CCOc1cccc(OCCN(CC)CC)c1OCCN(CC)CC

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.54
DRD2 P14416 1/20 0.53
DRD1 P21728 1/20 0.53
DRD3 P35462 1/20 0.53
ALDH1A1 P00352 3/20 0.49
LMNA P02545 2/20 0.49
HTR1B P28222 2/20 0.49
HTR1D P28221 1/20 0.49
CHRM2 P08172 2/20 0.49
TSHR P16473 2/20 0.49
CHRM1 P11229 1/20 0.49
ALOX15 P16050 1/20 0.49
ACHE P22303 1/20 0.49
KCNH2 Q12809 1/20 0.49
HIF1A Q16665 1/20 0.49
BIRC5 O15392 1/20 0.46
CYP1A2 P05177 1/20 0.44
LTA4H P09960 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 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
SCHEMBL2138 0.95 KDM4E (0.58) KDM4EDRD2DRD1DRD3ALDH1A1
SCHEMBL9596044 0.84 LMNA (0.54) KDM4EDRD2DRD1DRD3ALDH1A1
Hexamethonium SCHEMBL7212262 0.82 CHRM2 (0.49) KDM4EDRD2DRD1DRD3ALDH1A1
SCHEMBL9706154 0.81 DRD3 (0.67) KDM4EDRD2DRD1DRD3ALDH1A1
SCHEMBL3989063 0.78 KDM4E (0.41) KDM4EDRD2DRD1DRD3ALDH1A1
SCHEMBL14365443 0.77 KDM4E (0.46) KDM4EDRD2DRD1DRD3ALDH1A1
SCHEMBL11209770 0.76 ALDH1A1 (0.65) KDM4EDRD2DRD1ALDH1A1LMNA
SCHEMBL3265285 0.75 CHRM2 (0.59) KDM4EDRD2DRD1DRD3ALDH1A1
Guaiactamine SCHEMBL25797 0.75 ALDH1A1 (0.78) KDM4EDRD2DRD1DRD3ALDH1A1
SCHEMBL28428684 0.75 DRD3 (0.59) KDM4EDRD2DRD1DRD3ALDH1A1

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 1386 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4154879-B1 PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING NICOTINE WITHDRAWAL SYMPTOMS KOREA INST SCI & TECH (KR) 2025-09-10 EP claimed
EP-4178948-A2 FUNCTIONALIZED ISONITRILES AND PRODUCTS, PREPARATION AND USES THEREOF Universidade de Santiago de Compostela (ES) 2023-05-17 EP claimed
EP-4154879-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING NICOTINE WITHDRAWAL SYMPTOMS Korea Institute of Science and Technology (KR) 2023-03-29 EP claimed
WO-2022250365-A1 PHARMACEUTICAL COMPOSITION CONTAINING GALAMINE TRIETHIODIDE AS ACTIVE INGREDIENT FOR PREVENTING OR TREATING MUSCLE DISEASES 건국대학교 글로컬산학협력단 2022-12-01 WO claimed
EP-1931320-B1 MICROPARTICLES WITH MODIFIED RELEASE OF AT LEAST ONE ACTIVE PRINCIPLE AND ORAL DOSAGE FORM COMPRISING THE SAME FLAMEL IRELAND LTD (IE) 2022-06-15 EP claimed
WO-2022023496-A2 FUNCTIONALIZED ISONITRILES AND PRODUCTS, PREPARATION AND USES THEREOF UNIVERSIDADE DE SANTIAGO DE COMPOSTELA (ES) 2022-02-03 WO claimed
US-20190125734-A1 COMPOSITION FOR TREATING OR PREVENTING ATOPIC DERMATITIS NANOEGG RESEARCH LABORATORIES, INC. (JP) 2019-05-02 US claimed
EP-3456353-A1 COMPOSITION FOR TREATING OR PREVENTING ATOPIC DERMATITIS Nanoegg Research Laboratories, Inc. (JP) 2019-03-20 EP claimed
US-9016221-B2 Surface topographies for non-toxic bioadhesion control UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2015-04-28 US claimed
US-8268352-B2 Modified release composition for highly soluble drugs TORRENT PHARMACEUTICALS LIMITED (IN) 2012-09-18 US claimed
EP-1328261-A2 TREATMENT OF NEURODEGENERATIVE DISEASE Minerva Biotechnologies Corporation (US) 2003-07-23 EP claimed
US-20030060487-A1 Treatment of neurodegenerative disease MINERVA BIOTECHNOLOGIES CORPORATION 2003-03-27 US claimed
EP-0983060-A4 SOLID POROUS MATRICES AND METHODS OF MAKING AND USING THE SAME IMARX PHARMACEUTICAL CORP (US) 2002-04-24 EP claimed
US-20020039594-A1 SOLID POROUS MATRICES AND METHODS OF MAKING AND USING THE SAME IMARX THERAPEUTICS, INC. 2002-04-04 US claimed
WO-2001078709-A2 TREATMENT OF NEURODEGENERATIVE DISEASE MINERVA BIOTECHNOLOGIES CORPORATION (US) 2001-10-25 WO claimed
EP-1073470-A1 PHARMACEUTICAL COMPOSITIONS CONTAINING COMPOUNDS WITH ACTIVITY FOR THE ENHANCEMENT OF ABSORPTION OF ACTIVE INGREDIENTS INPHARMA S.A. (CH) 2001-02-07 EP claimed
WO-2000048636-A1 PHARMACEUTICAL COMPOSITIONS CONTAINING COMPOUNDS WITH ACTIVITY FOR THE ENHANCEMENT OF ABSORPTION OF ACTIVE INGREDIENTS INPHARMA S.A. (CH) 2000-08-24 WO claimed
EP-0983060-A1 SOLID POROUS MATRICES AND METHODS OF MAKING AND USING THE SAME IMARX PHARMACEUTICAL CORP. (US) 2000-03-08 EP claimed
WO-1998051282-A1 SOLID POROUS MATRICES AND METHODS OF MAKING AND USING THE SAME IMARX PHARMACEUTICAL CORP. (US) 1998-11-19 WO claimed
US-5770222-A Therapeutic drug delivery systems IMARX PHARMACEUTICAL CORP. (US) 1998-06-23 US 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 (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-20030060487-A1 Treatment of neurodegenerative disease HTT, IAPP, APP KDM4E 3431/4885DRD2 4115/4885DRD1 4060/4885
US-20190125734-A1 COMPOSITION FOR TREATING OR PREVENTING ATOPIC DERMATITIS CHRM3, ACHE, CHRNB1 KDM4E 2864/4885DRD2 1243/4885DRD1 1906/4885
US-20020039594-A1 SOLID POROUS MATRICES AND METHODS OF MAKING AND USING THE SAME EXOSC9, EXOSC5, EXOSC4 KDM4E 1279/4885DRD2 2359/4885DRD1 3668/4885

“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.