SCHEMBL3736014

SCHEMBL3736014

COc1ccc(-c2oc3cc(OC)ccc3c2C(=O)c2ccc(C#N)cc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 11/20 1.00
CNR1 P21554 8/20 1.00
CYP3A4 P08684 2/20 1.00
MAPT P10636 2/20 1.00
CASP1 P29466 2/20 1.00
CASP7 P55210 2/20 1.00
ALOX15 P16050 1/20 1.00
SMN1; SMN2 Q16637 1/20 1.00
L3MBTL1 Q9Y468 2/20 0.63
KDM4E B2RXH2 1/20 0.52
MEN1 O00255 1/20 0.52
ALDH1A1 P00352 1/20 0.52
TP53 P04637 1/20 0.52
HPGD P15428 1/20 0.52
KMT2A Q03164 1/20 0.52
HSD17B10 Q99714 1/20 0.52
BCHE P06276 3/20 0.51
CYP19A1 P11511 1/20 0.50
SLC22A12 Q96S37 1/20 0.50
ATM Q13315 1/20 0.48

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
SCHEMBL7123280 0.95 CNR2 (0.90) CNR2CNR1CYP3A4MAPTCASP1
SCHEMBL8270651 0.92 CNR2 (0.86) CNR2CNR1CYP3A4MAPTCASP1
SCHEMBL6746977 0.91 CNR2 (0.82) CNR2CNR1CYP3A4MAPTCASP1
SCHEMBL684780 0.90 CNR2 (0.81) CNR2CNR1CYP3A4MAPTCASP1
SCHEMBL6748804 0.86 CNR2 (0.75) CNR2CNR1CYP3A4MAPTCASP1
SCHEMBL7640834 0.85 CNR2 (0.74) CNR2CNR1CYP3A4MAPTCASP1
SCHEMBL7638171 0.81 CNR2 (0.69) CNR2CNR1CYP3A4MAPTCASP1
SCHEMBL4653103 0.81 CNR1 (0.67) CNR2CNR1CYP3A4MAPTCASP1
SCHEMBL5024772 0.79 CYP3A4 (0.65) CNR2CNR1CYP3A4MAPTCASP1
SCHEMBL24046767 0.79 CYP3A4 (0.79) CNR2CNR1CYP3A4MAPTCASP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022204414-A1 FORMULATIONS AND KITS FOR THE DIAGNOSTIC EVALUATION OF INFECTIOUS DISEASES AND METHODS THEREOF VYRIPHARM ENTERPRISES, INC. (US) 2022-09-29 WO claimed
WO-2022204419-A1 SYNTHETIC CANNABINOID COMBINATION THERAPY COMPOSITIONS AND METHODS FOR PERSONALIZED AND TARGETED THERAPIES INCLUDING THE TREATMENT OF INFECTIOUS DISEASES VYRIPHARM ENTERPRISES, INC. (US) 2022-09-29 WO claimed
EP-2739262-B1 USE OF A CB1 RECEPTOR ANTAGONIST AS A WHITENING AND/OR ANTI-BROWNING AGENT FOR KERATIN MATERIAL OREAL (FR) 2017-09-27 EP claimed
EP-2739262-A2 USE OF A CB1 RECEPTOR ANTAGONIST AS A WHITENING AND/OR ANTI-BROWNING AGENT FOR KERATIN MATERIAL L'OREAL (FR) 2014-06-11 EP claimed
US-20140142106-A1 METHOD FOR TREATING PERITONEAL FIBROSIS TAIPEI VETERANS GENERAL HOSPITAL (TW) 2014-05-22 US claimed
WO-2013021129-A2 USE OF A CB1 RECEPTOR ANTAGONIST AS A WHITENING AND/OR ANTI-BROWNING AGENT FOR KERATIN MATERIAL L'OREAL (FR) 2013-02-14 WO claimed
EP-2084127-A1 DIARYL, DIPYRIDINYL AND ARYL-PYRIDINYL DERIVATIVES AND USES THEREOF Pfizer Products Inc. (US) 2009-08-05 EP claimed
EP-2064199-A1 DIARYL ETHER DERIVATIVES AND USES THEREOF Pfizer Products Inc. (US) 2009-06-03 EP claimed
WO-2008059335-A1 DIARYL, DIPYRIDINYL AND ARYL-PYRIDINYL DERIVATIVES AND USES THEREOF PFIZER PRODUCTS INC. (US) 2008-05-22 WO claimed
US-20080070887-A1 Diaryl Ether Derivatives and Uses Thereof PFIZER INC 2008-03-20 US claimed
WO-2008032156-A1 DIARYL ETHER DERIVATIVES AND USES THEREOF PFIZER PRODUCTS INC. (US) 2008-03-20 WO claimed
EP-1890767-A2 COMBINATION OF A CANNABINOID-1- RECEPTOR-ANTAGONIST AND A MICROSOMAL TRIGLYCERIDE TRANSFER PROTEIN INHIBITOR FOR TREATING OBESITY OR MAINATAINING WEIGHT LOSS Pfizer Products Inc. (US) 2008-02-27 EP claimed
WO-2007039797-A1 USE OF CANNABINOID RECEPTOR-1 ANTAGONIST FOR TREATING INFLAMMATION AND ARTHRITIS PFIZER PRODUCTS INC. (US) 2007-04-12 WO claimed
WO-2006129193-A2 COMBINATION OF A CANNABINOID-1- RECEPTOR-ANTAGONIST AND A MICROSOMAL TRIGLYCERIDE TRANSFER PROTEIN INHIBITOR FOR TREATING OBESITY OR MAINATAINING WEIGHT LOSS PFIZER PRODUCTS INC. (US) 2006-12-07 WO claimed
US-20060270655-A1 Combination therapy for treating obesity or maintaining weight loss SWICK ANDREW G 2006-11-30 US claimed
US-20060160776-A1 Compositions of a cyclooxygenase-2 selective inhibitor and a cannabinoid agent for the treatment of central nervous system damage PHARMACIA CORPORATION 2006-07-20 US claimed
WO-2004105699-A2 COMPOSITIONS OF A CYCLOOXYGENASE-2 SELECTIVE INHIBITOR AND A CANNABINOID AGENT FOR THE TREATMENT OF CENTRAL NERVOUS SYSTEM DAMAGE PHARMACIA CORPORATION (US) 2004-12-09 WO claimed
US-20240024403-A1 Compositions and Methods for Managing Weight UNIGEN, INC. (US) 2024-01-25 US disclosed
US-5596106-A ARYL-BENZO(B)THIOPHENE OR BENZO(B)FURAN COMPOUNDS ELI LILLY AND COMPANY (US) 1997-01-21 US disclosed
WO-1996002248-A1 CANNABINOID RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 1996-02-01 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 (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-20080070887-A1 Diaryl Ether Derivatives and Uses Thereof OPRD1, OPRK1, OPRL1 CNR2 20/4885CNR1 13/4885CYP3A4 451/4885
US-20240024403-A1 Compositions and Methods for Managing Weight LIPE, PNLIP, LIPC CNR2 13/4885CNR1 12/4885CYP3A4 795/4885
US-20060160776-A1 Compositions of a cyclooxygenase-2 selective inhibitor and a cannabinoid agent for the treatment of central nervous system damage CNR2, CNR1, PTGS2 CNR2 1/4885CNR1 2/4885CYP3A4 2623/4885

“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.