SCHEMBL1991744

SCHEMBL1991744

COc1cc(CC(N)=O)cc(OC)c1OC

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.53
HTR2A P28223 1/20 0.53
HTR2C P28335 1/20 0.53
HTR2B P41595 1/20 0.53
KMT2A Q03164 4/20 0.52
KDM4E B2RXH2 2/20 0.52
ALDH1A1 P00352 2/20 0.52
MAPK10 P53779 2/20 0.52
MEN1 O00255 2/20 0.52
HTT P42858 1/20 0.52
LMNA P02545 1/20 0.48
TSHR P16473 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
GAA P10253 1/20 0.48
CYP19A1 P11511 1/20 0.47
AOC3 Q16853 1/20 0.47

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
SCHEMBL4686135 0.88 TSHR (0.59) KMT2AKDM4EALDH1A1MAPK10MEN1
SCHEMBL9686940 0.87 GAA (0.45) PTGS2HTR2AHTR2CHTR2BKMT2A
SCHEMBL6462475 0.85 ALOX5 (0.51) PTGS2KMT2AKDM4EALDH1A1MEN1
SCHEMBL7046945 0.84 PTGS2 (0.57) PTGS2HTR2AHTR2CHTR2BKMT2A
SCHEMBL499116 0.82 GAA (0.61) PTGS2HTR2AHTR2CHTR2BKMT2A
SCHEMBL4965033 0.82 PTGS2 (0.55) PTGS2HTR2AHTR2CHTR2BKMT2A
SCHEMBL2307800 0.82 PTGS2 (0.55) PTGS2HTR2AHTR2CHTR2BKMT2A
SCHEMBL2930056 0.81 HTR2A (0.59) PTGS2HTR2AHTR2CHTR2BKMT2A
SCHEMBL10744953 0.81 ALDH1A1 (0.56) KMT2AKDM4EALDH1A1MAPK10MEN1
SCHEMBL31186754 0.81 ALDH1A1 (0.46) ALDH1A1HTTLMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250162980-A1 METHODS FOR PREPARING MESCALINE JOURNEY COLAB CORP. 2025-05-22 US claimed
US-20240245632-A1 METHODS OF TREATING SUBSTANCE USE DISORDERS USING MESCALINE JOURNEY COLAB CORP. 2024-07-25 US claimed
WO-2023164178-A2 METHODS FOR PREPARING MESCALINE JOURNEY COLAB CORP. (US) 2023-08-31 WO claimed
WO-2022251690-A1 MESCALINE FOR THE TREATMENT OF SUBSTANCE USE DISORDERS JOURNEY COLAB CORP. (US) 2022-12-01 WO claimed
US-20250162980-A1 METHODS FOR PREPARING MESCALINE JOURNEY COLAB CORP. 2025-05-22 US disclosed
US-20250162980-A1 METHODS FOR PREPARING MESCALINE JOURNEY COLAB CORP. 2025-05-22 US disclosed
US-20240245632-A1 METHODS OF TREATING SUBSTANCE USE DISORDERS USING MESCALINE JOURNEY COLAB CORP. 2024-07-25 US disclosed
CN-117723691-A Detection method of 1- [3- (dimethylamino) propyl ] -3-ethylurea 珠海优泽生物科技有限公司 2024-03-19 CN disclosed
WO-2023164178-A3 METHODS FOR PREPARING MESCALINE JOURNEY COLAB CORP. (US) 2023-10-05 WO disclosed
WO-2023164178-A2 METHODS FOR PREPARING MESCALINE JOURNEY COLAB CORP. (US) 2023-08-31 WO disclosed
WO-2023164178-A2 METHODS FOR PREPARING MESCALINE JOURNEY COLAB CORP. (US) 2023-08-31 WO disclosed
CN-116496281-A Benzonitrogen Zhuo Luo indoline compound and synthetic method and application thereof 重庆文理学院 2023-07-28 CN disclosed
US-5753644-A Vasopressin antagonist and oxytocin antagonist OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1998-05-19 US disclosed
US-5622947-A VASODILATORS, HYPOTENSIVE AGENTS, DIURETICS, PLATELET AGGLUTINATION INHIBITORS; ALSO USED TO PREVENT PREMATURE BIRTH, TREAT DYSMENORRHEA OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-04-22 US disclosed
EP-0514667-B1 Benzazepin derivatives as vasopressin antagonists OTSUKA PHARMA CO LTD (JP) 1995-08-09 EP disclosed
EP-0620003-A1 VASOPRESSIN ANTAGONIST AND OXYTOCIN ANTAGONIST OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-10-19 EP disclosed
US-5244898-A Vasopressin antagonist OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1993-09-14 US disclosed
EP-0514667-A1 Benzazepin derivatives as vasopressin antagonists OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1992-11-25 EP disclosed
EP-0306440-A2 1-(4-substituted phenyl)-1H-imidazoles as cardiovascular agents SCHERING AKTIENGESELLSCHAFT (DE) 1989-03-08 EP disclosed
US-4668814-A ANTIULCER AGENTS, ANTIASHMATICS, ANTICOAGULANTS THE UPJOHN COMPANY (US) 1987-05-26 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 (2 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-20240245632-A1 METHODS OF TREATING SUBSTANCE USE DISORDERS USING MESCALINE SLC6A12, SLC6A3, TPMT PTGS2 3134/4885HTR2A 93/4885HTR2C 24/4885
US-20250162980-A1 METHODS FOR PREPARING MESCALINE IL4I1, ME3, LIG3 PTGS2 3397/4885HTR2A 3249/4885HTR2C 2131/4885

“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.