SCHEMBL896903

SCHEMBL896903

CCN[C@H](C)Cc1ccc2c(c1)OCO2

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.72
SLC6A4 P31645 3/20 0.72
SLC6A2 P23975 2/20 0.72
SLC6A3 Q01959 2/20 0.72
CYP2D6 P10635 2/20 0.72
KDM4E B2RXH2 1/20 0.57
ALDH1A1 P00352 1/20 0.57
TSHR P16473 1/20 0.57
CYP3A4 P08684 2/20 0.54
NPSR1 Q6W5P4 1/20 0.54
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
ADRB2 P07550 1/20 0.51
ADRB1 P08588 1/20 0.51
ADRB3 P13945 1/20 0.51
ADRA1D P25100 1/20 0.51
ADRA1A P35348 1/20 0.51
ADRA1B P35368 1/20 0.51
GAA P10253 1/20 0.49
MAPT P10636 1/20 0.49

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
SCHEMBL25188324 1.00 TAAR1 (0.72) TAAR1SLC6A4SLC6A2SLC6A3CYP2D6
SCHEMBL715096 1.00 TAAR1 (0.72) TAAR1SLC6A4SLC6A2SLC6A3CYP2D6
SCHEMBL30434262 1.00 TAAR1 (0.72) TAAR1SLC6A4SLC6A2SLC6A3CYP2D6
SCHEMBL30503037 1.00 TAAR1 (0.72) TAAR1SLC6A4SLC6A2SLC6A3CYP2D6
SCHEMBL29350327 1.00 TAAR1 (0.72) TAAR1SLC6A4SLC6A2SLC6A3CYP2D6
Hydrochloric Acid SCHEMBL35210364 0.98 TAAR1 (0.70) TAAR1SLC6A4SLC6A2SLC6A3CYP2D6
Hydrochloric Acid SCHEMBL30448521 0.98 TAAR1 (0.70) TAAR1SLC6A4SLC6A2SLC6A3CYP2D6
Hydrochloric Acid SCHEMBL25314458 0.98 TAAR1 (0.70) TAAR1SLC6A4SLC6A2SLC6A3CYP2D6
Hydrochloric Acid SCHEMBL5301741 0.98 TAAR1 (0.70) TAAR1SLC6A4SLC6A2SLC6A3CYP2D6
SCHEMBL29633088 0.88 TAAR1 (0.68) TAAR1SLC6A4SLC6A2SLC6A3CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4433466-A2 PHENETHYLAMINE COMPOUNDS SALTS, POLYMORPHIC FORMS AND METHODS OF USE THEREOF Terran Biosciences Inc. (US) 2024-09-25 EP claimed
WO-2023092044-A2 PHENETHYLAMINE COMPOUNDS SALTS, POLYMORPHIC FORMS AND METHODS OF USE THEREOF TERRAN BIOSCIENCES, INC. (US) 2023-05-25 WO claimed
US-12577222-B2 Phenethylamine compounds salts, polymorphic forms and methods of use thereof TERRAN BIOSCIENCES INC. (US) 2026-03-17 US disclosed
EP-3710837-B1 CATHINONE TEST UNIV SYDNEY TECHNOLOGY (AU) 2025-05-07 EP disclosed
US-20240409526-A1 PHENETHYLAMINE COMPOUNDS SALTS, POLYMORPHIC FORMS AND METHODS OF USE THEREOF TERRAN BIOSCIENCES INC (US) 2024-12-12 US disclosed
US-20240342126-A1 HALLUCINOGEN-FATTY ACID COMBINATION MINDSET PHARMA INC. (CA) 2024-10-17 US disclosed
US-20240327371-A1 PHENETHYLAMINE COMPOUNDS SALTS, POLYMORPHIC FORMS AND METHODS OF USE THEREOF TERRAN BIOSCIENCES INC. (US) 2024-10-03 US disclosed
EP-4433466-A2 PHENETHYLAMINE COMPOUNDS SALTS, POLYMORPHIC FORMS AND METHODS OF USE THEREOF Terran Biosciences Inc. (US) 2024-09-25 EP disclosed
US-11958821-B2 Phenethylamine compounds salts, polymorphic forms and methods of use thereof TERRAN BIOSCIENCES INC. (US) 2024-04-16 US disclosed
US-11808775-B2 Cathinone test UNIVERSITY OF TECHNOLOGY SYDNEY 2023-11-07 US disclosed
US-20230227422-A1 PHENETHYLAMINE COMPOUNDS SALTS, POLYMORPHIC FORMS AND METHODS OF USE THEREOF TERRAN BIOSCIENCES INC. 2023-07-20 US disclosed
US-20230150966-A1 ISOTOPICALLY ENRICHED 3,4-METHYLENEDIOXY-N-ETHYLAMPHETAMINE (MDE) AND STEREOISOMERS THEREOF TERRAN BIOSCIENCES INC (US) 2023-05-18 US disclosed
US-20230150966-A1 ISOTOPICALLY ENRICHED 3,4-METHYLENEDIOXY-N-ETHYLAMPHETAMINE (MDE) AND STEREOISOMERS THEREOF TERRAN BIOSCIENCES INC (US) 2023-05-18 US disclosed
WO-2023081897-A1 ISOTOPICALLY ENRICHED 3,4-METHYLENEDIOXY-N-ETHYLAMPHETAMINE (MDE) AND STEREOISOMERS THEREOF TERRAN BIOSCIENCES, INC. (US) 2023-05-11 WO disclosed
WO-2023081897-A1 ISOTOPICALLY ENRICHED 3,4-METHYLENEDIOXY-N-ETHYLAMPHETAMINE (MDE) AND STEREOISOMERS THEREOF TERRAN BIOSCIENCES, INC. (US) 2023-05-11 WO disclosed
US-8793078-B2 Method for predicting activation energy using atomic fingerprint descriptor or atomic descriptor BIOINFORMATICS & MOLECULAR DESIGN RESEARCH CENTER (KR) 2014-07-29 US disclosed
US-20120084012-A1 METHOD FOR PREDICTING ACTIVATION ENERGY USING ATOMIC FINGERPRINT DESCRIPTOR OR ATOMIC DESCRIPTOR BIOINFORMATICS & MOLECULAR DESIGN RESEARCH CENTER (KR) 2012-04-05 US disclosed
US-20110213558-A1 METHOD FOR PREDICTING ACTIVATION ENERGY USING AN ATOMIC FINGERPRINT DESCRIPTOR OR AN ATOMIC DESCRIPTOR BIOINFORMATICS & MOLECULAR DESIGN RESEARCH CENTER (KR) 2011-09-01 US disclosed
EP-2354987-A2 METHOD FOR PREDICTING ACTIVATION ENERGY USING AN ATOMIC FINGERPRINT DESCRIPTOR OR AN ATOMIC DESCRIPTOR Bioinformatics&Molecular Design Research Center (KR) 2011-08-10 EP disclosed
WO-2010056053-A2 METHOD FOR PREDICTING ACTIVATION ENERGY USING AN ATOMIC FINGERPRINT DESCRIPTOR OR AN ATOMIC DESCRIPTOR 사단법인 분자설계연구소 (KR) 2010-05-20 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 (7 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-12577222-B2 Phenethylamine compounds salts, polymorphic forms and methods of use thereof DRD2, DRD1, DRD3 TAAR1 81/4885SLC6A4 59/4885SLC6A2 17/4885
US-20240409526-A1 PHENETHYLAMINE COMPOUNDS SALTS, POLYMORPHIC FORMS AND METHODS OF USE THEREOF DRD2, DRD3, DRD1 TAAR1 133/4885SLC6A4 16/4885SLC6A2 11/4885
US-20240342126-A1 HALLUCINOGEN-FATTY ACID COMBINATION FAAH, HTR5A, FAAH2 TAAR1 47/4885SLC6A4 44/4885SLC6A2 58/4885
US-20230150966-A1 ISOTOPICALLY ENRICHED 3,4-METHYLENEDIOXY-N-ETHYLAMPHETAMINE (MDE) AND STEREOISOMERS THEREOF SLC6A3, DBH, PNMT TAAR1 103/4885SLC6A4 12/4885SLC6A2 10/4885
US-20240327371-A1 PHENETHYLAMINE COMPOUNDS SALTS, POLYMORPHIC FORMS AND METHODS OF USE THEREOF DRD2, DRD3, DRD1 TAAR1 133/4885SLC6A4 16/4885SLC6A2 11/4885
US-20230227422-A1 PHENETHYLAMINE COMPOUNDS SALTS, POLYMORPHIC FORMS AND METHODS OF USE THEREOF DRD2, DRD3, DRD1 TAAR1 133/4885SLC6A4 16/4885SLC6A2 11/4885
US-11958821-B2 Phenethylamine compounds salts, polymorphic forms and methods of use thereof DRD2, DRD3, DRD1 TAAR1 133/4885SLC6A4 16/4885SLC6A2 11/4885

“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.