SCHEMBL3564472

SCHEMBL3564472

CCN(CCO)Cc1csc(-c2cn(CC3CCOCC3)c3c(Cl)cccc23)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 20/20 1.00
KCNH2 Q12809 19/20 1.00
CYP1A1 P04798 1/20 0.79
CYP2C8 P10632 1/20 0.79
CYP2D6 P10635 1/20 0.79
CYP2C9 P11712 1/20 0.79
CYP2C19 P33261 1/20 0.79

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
SCHEMBL3574139 0.93 CNR1 (1.00) CNR1KCNH2CYP1A1CYP2C8CYP2D6
SCHEMBL3566537 0.89 CNR1 (1.00) CNR1KCNH2CYP1A1CYP2C8CYP2D6
SCHEMBL3570283 0.84 CNR1 (0.82) CNR1KCNH2CYP1A1CYP2C8CYP2D6
SCHEMBL3187657 0.82 CNR1 (0.79) CNR1KCNH2CYP1A1CYP2C8CYP2D6
SCHEMBL3566442 0.82 CNR1 (1.00) CNR1KCNH2CYP1A1CYP2C8CYP2D6
SCHEMBL3517154 0.79 CNR1 (0.74) CNR1KCNH2CYP1A1CYP2C8CYP2D6
SCHEMBL29290976 0.79 CNR1 (0.65) CNR1KCNH2CYP1A1CYP2C8CYP2D6
SCHEMBL13437706 0.75 CNR1 (0.60) CNR1KCNH2CYP1A1CYP2C8CYP2D6
SCHEMBL3177288 0.75 CNR1 (0.80) CNR1KCNH2CYP1A1CYP2C8CYP2D6
SCHEMBL3572791 0.75 CNR1 (0.83) CNR1KCNH2

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200289458-A1 TOPICAL FORMULATIONS OF CANNABINOIDS AND USE THEREOF IN THE TREATMENT OF PAIN INMED PHARMACEUTICALS INC (CA) 2020-09-17 US claimed
US-20190142788-A1 USE OF TOPICAL FORMULATIONS OF CANNABINOIDS IN THE TREATMENT OF EPIDERMOLYSIS BULLOSA AND RELATED CONNECTIVE TISSUE DISORDERS INMED PHARMACEUTICALS INC. (CA) 2019-05-16 US claimed
US-7700634-B2 (Indol-3-yl) heterocycle derivatives as agonists of the cannabinoid CB1 receptor N.V. ORGANON (NL) 2010-04-20 US claimed
EP-1725232-B1 (INDOL-3-YL)-HETEROCYCLE DERIVATIVES AS AGONISTS OF THE CANNABINOID CB1 RECEPTOR ORGANON NV (NL) 2008-01-23 EP claimed
US-12357604-B2 Topical formulations of cannabinoids and use thereof in the treatment of pain INMED PHARMACEUTICALS INC. (CA) 2025-07-15 US disclosed
US-12042479-B2 Use of topical formulations of cannabinoids in the treatment of epidermolysis bullosa and related connective tissue disorders INMED PHARMACEUTICALS INC. 2024-07-23 US disclosed
US-20200289458-A1 TOPICAL FORMULATIONS OF CANNABINOIDS AND USE THEREOF IN THE TREATMENT OF PAIN INMED PHARMACEUTICALS INC (CA) 2020-09-17 US disclosed
US-20190142788-A1 USE OF TOPICAL FORMULATIONS OF CANNABINOIDS IN THE TREATMENT OF EPIDERMOLYSIS BULLOSA AND RELATED CONNECTIVE TISSUE DISORDERS INMED PHARMACEUTICALS INC. (CA) 2019-05-16 US disclosed
US-7700634-B2 (Indol-3-yl) heterocycle derivatives as agonists of the cannabinoid CB1 receptor N.V. ORGANON (NL) 2010-04-20 US disclosed
US-7700634-B2 (Indol-3-yl) heterocycle derivatives as agonists of the cannabinoid CB1 receptor N.V. ORGANON (NL) 2010-04-20 US disclosed
EP-1725232-B1 (INDOL-3-YL)-HETEROCYCLE DERIVATIVES AS AGONISTS OF THE CANNABINOID CB1 RECEPTOR ORGANON NV (NL) 2008-01-23 EP disclosed
US-20070142446-A1 (Indol-3-yl) heterocycle derivatives as a agonists of the cannabinoid cb1 receptor MERCK SHARP & DOHME B.V. (NL) 2007-06-21 US disclosed
US-20070142446-A1 (Indol-3-yl) heterocycle derivatives as a agonists of the cannabinoid cb1 receptor MERCK SHARP & DOHME B.V. (NL) 2007-06-21 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 (5 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-20070142446-A1 (Indol-3-yl) heterocycle derivatives as a agonists of the cannabinoid cb1 receptor CNR1, CNR2, OPRL1 CNR1 1/4885KCNH2 1011/4885CYP1A1 394/4885
US-12357604-B2 Topical formulations of cannabinoids and use thereof in the treatment of pain CNR2, CNR1, LCAT CNR1 2/4885KCNH2 3256/4885CYP1A1 1301/4885
US-20200289458-A1 TOPICAL FORMULATIONS OF CANNABINOIDS AND USE THEREOF IN THE TREATMENT OF PAIN CNR2, CNR1, LCAT CNR1 2/4885KCNH2 3256/4885CYP1A1 1301/4885
US-12042479-B2 Use of topical formulations of cannabinoids in the treatment of epidermolysis bullosa and related connective tissue disorders KRT18, DSP, DSC1 CNR1 60/4885KCNH2 2662/4885CYP1A1 4129/4885
US-20190142788-A1 USE OF TOPICAL FORMULATIONS OF CANNABINOIDS IN THE TREATMENT OF EPIDERMOLYSIS BULLOSA AND RELATED CONNECTIVE TISSUE DISORDERS KRT18, DSP, DSC1 CNR1 60/4885KCNH2 2662/4885CYP1A1 4129/4885

“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.