SCHEMBL945043

SCHEMBL945043

COCCn1c(C)c(C)s/c1=N\C(=O)C1C(C)(C)C1(C)C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 7/20 1.00
CNR1 P21554 5/20 1.00
PIM1 P11309 1/20 0.48
CLK2 P49760 1/20 0.48
CLK4 Q9HAZ1 1/20 0.48
KMT2A Q03164 4/20 0.36
ALDH1A1 P00352 4/20 0.35
NPSR1 Q6W5P4 2/20 0.33
MEN1 O00255 2/20 0.33
HPGD P15428 3/20 0.32
KDM4E B2RXH2 2/20 0.32
MAPT P10636 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
POLB P06746 1/20 0.32
GAA P10253 1/20 0.32
THRB P10828 1/20 0.32
RECQL P46063 1/20 0.32
XIAP P98170 1/20 0.32
PLEC Q15149 1/20 0.32
ADORA2B P29275 1/20 0.32

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
SCHEMBL945045 1.00 CNR2 (1.00) CNR2CNR1PIM1CLK2CLK4
SCHEMBL26376123 1.00 CNR2 (1.00) CNR2CNR1PIM1CLK2CLK4
SCHEMBL3382611 0.88 CNR2 (0.78) CNR2CNR1PIM1CLK2CLK4
SCHEMBL3382608 0.88 CNR2 (0.78) CNR2CNR1PIM1CLK2CLK4
SCHEMBL26376128 0.85 CNR2 (0.74) CNR2CNR1PIM1CLK2CLK4
SCHEMBL944836 0.85 CNR2 (0.73) CNR2CNR1PIM1CLK2CLK4
SCHEMBL944835 0.85 CNR2 (0.73) CNR2CNR1PIM1CLK2CLK4
SCHEMBL24194110 0.83 CNR2 (0.70) CNR2CNR1PIM1CLK2CLK4
SCHEMBL26376471 0.82 CNR2 (0.80) CNR2CNR1PIM1CLK2CLK4
SCHEMBL26376130 0.82 CNR2 (0.93) CNR2CNR1PIM1CLK2CLK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3664795-B1 CANNABIS AND DERIVATIVES THEREOF FOR THE TREATMENT OF PAIN AND INFLAMMATION RELATED WITH DENTAL PULP AND BONE REGENERATION RELATED TO DENTAL JAW BONE DEFECTS CANNIBITE BVBA (BE) 2024-06-19 EP claimed
CN-117100863-A Use of cannabinoid systems and downstream pathways thereof for preventing and/or treating chronic itch 南方科技大学 2023-11-24 CN claimed
EP-2211860-B1 COMBINATION THERAPY FOR REDUCING SIDE EFFECTS USING CANNABINOID RECEPTOR LIGANDS ABBVIE INC (US) 2015-04-08 EP claimed
US-8044071-B2 Method for reducing side effects of CB2 receptor agonist therapy using a combination of a selective CB2 receptor agonist and a selective CB1 receptor antagonist ABBOTT LABORATORIES (US) 2011-10-25 US claimed
EP-4646477-A2 METHODS AND COMPOSITIONS FOR DISPLAYING PEPTIDE LIBRARIES Board of Regents, The University of Texas System (US) 2025-11-12 EP disclosed
US-20250027072-A1 METHODS AND COMPOSITIONS RELATED TO ENGINEERED CANNABINOID RECEPTORS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2025-01-23 US disclosed
EP-4178951-B1 DEUTERATED AND TRITIATED N-(4,5-DIMETHYLTHIAZOLO-2(3H)-YLIDEN)-2,2,3,3-TETRAMETHYLCYCLOPROPANE-1-CARBOXAMIDE DERIVATIVES AND THEIR USE HELMHOLTZ ZENTRUM DRESDEN (DE) 2024-12-11 EP disclosed
EP-4441203-A1 METHODS AND COMPOSITIONS RELATED TO ENGINEERED CANNABINOID RECEPTORS Board of Regents, The University of Texas System (US) 2024-10-09 EP disclosed
WO-2024148130-A2 METHODS AND COMPOSITIONS FOR DISPLAYING PEPTIDE LIBRARIES BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2024-07-11 WO disclosed
EP-3664795-B1 CANNABIS AND DERIVATIVES THEREOF FOR THE TREATMENT OF PAIN AND INFLAMMATION RELATED WITH DENTAL PULP AND BONE REGENERATION RELATED TO DENTAL JAW BONE DEFECTS CANNIBITE BVBA (BE) 2024-06-19 EP disclosed
CN-117100863-A Use of cannabinoid systems and downstream pathways thereof for preventing and/or treating chronic itch 南方科技大学 2023-11-24 CN disclosed
US-20230312493-A1 DEUTERATED AND TRITIATED N-(4,5-DIMETHYLTHIAZOLO-2(3H)-YLIDEN)-2,2,3,3-TETRAMETHYLCYCLOPROPANE-1-CARBOXAMIDE DERIVATIVES AND THE USE THEREOF HELMHOLTZ-ZENTRUM DRESDEN-ROSSENDORF E.V. (DE) 2023-10-05 US disclosed
EP-2222165-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS AND USES THEREOF ABBOTT LABORATORIES (US) 2010-09-01 EP disclosed
EP-2211860-A1 COMBINATION THERAPY FOR REDUCING SIDE EFFECTS USING CANNABINOID RECEPTOR LIGANDS Abbott Laboratories (US) 2010-08-04 EP disclosed
US-20100093814-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS AND USES THEREOF ABBOTT LABORATORIES (US) 2010-04-15 US disclosed
WO-2009067613-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS AND USES THEREOF ABBOTT LABORATORIES (US) 2009-05-28 WO disclosed
US-20090105304-A1 COMBINATION THERAPY FOR REDUCING SIDE EFFECTS USING CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2009-04-23 US disclosed
WO-2009052342-A1 COMBINATION THERAPY FOR REDUCING SIDE EFFECTS USING CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2009-04-23 WO disclosed
US-20080242654-A1 N-[(2Z)-3-butyl-4,5-dimethyl-1,3-thiazol-2(3H)-ylidene]-5-chloro-N',2-dimethoxybenzenecarboximidamide; CB2 receptors ligand; antiinflammatory, analgesic agent; autoimmune diseases; neuroprotectants ABBOTT LABORATORIES (US) 2008-10-02 US disclosed
US-20080058335-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS AND USES THEREOF ABBVIE INC. 2008-03-06 US 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 (6 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-20230312493-A1 DEUTERATED AND TRITIATED N-(4,5-DIMETHYLTHIAZOLO-2(3H)-YLIDEN)-2,2,3,3-TETRAMETHYLCYCLOPROPANE-1-CARBOXAMIDE DERIVATIVES AND THE USE THEREOF CD22, CD2, CDY1; CDY1B CNR2 514/4885CNR1 1015/4885PIM1 1849/4885
US-20080242654-A1 N-[(2Z)-3-butyl-4,5-dimethyl-1,3-thiazol-2(3H)-ylidene]-5-chloro-N',2-dimethoxybenzenecarboximidamide; CB2 receptors ligand; antiinflammatory, analgesic agent; autoimmune diseases; neuroprotectants CNR2, CNR1, TRPV1 CNR2 1/4885CNR1 2/4885PIM1 4677/4885
US-20100093814-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS AND USES THEREOF CNR1, CNR2, OPRL1 CNR2 2/4885CNR1 1/4885PIM1 3054/4885
US-20090105304-A1 COMBINATION THERAPY FOR REDUCING SIDE EFFECTS USING CANNABINOID RECEPTOR LIGANDS CNR2, CNR1, GPR18 CNR2 1/4885CNR1 2/4885PIM1 4789/4885
US-20250027072-A1 METHODS AND COMPOSITIONS RELATED TO ENGINEERED CANNABINOID RECEPTORS CNR1, CNR2, GPR3 CNR2 2/4885CNR1 1/4885PIM1 2622/4885
US-20080058335-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS AND USES THEREOF CNR1, CNR2, OPRL1 CNR2 2/4885CNR1 1/4885PIM1 3231/4885

“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.