SCHEMBL497585

SCHEMBL497585

CC(Cc1ccccc1)NC1COCO1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 10/20 0.46
TAAR1 Q96RJ0 3/20 0.46
SLC18A2 Q05940 1/20 0.46
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
CYP2D6 P10635 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
TSHR P16473 1/20 0.41
LMNA P02545 1/20 0.40

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
SCHEMBL33991 0.78 SIGMAR1 (0.52) SIGMAR1TAAR1SLC18A2MEN1KMT2A
Hydrochloric Acid SCHEMBL5653344 0.76 SIGMAR1 (0.50) SIGMAR1TAAR1SLC18A2MEN1KMT2A
SCHEMBL3681409 0.74 SIGMAR1 (0.52) SIGMAR1TAAR1SLC18A2MEN1KMT2A
SCHEMBL15848206 0.72 EPHX1 (0.44) SIGMAR1TAAR1SLC18A2
SCHEMBL20061130 0.69 SIGMAR1 (0.56) SIGMAR1TAAR1SLC18A2MEN1KMT2A
SCHEMBL20061148 0.69 SIGMAR1 (0.56) SIGMAR1TAAR1SLC18A2MEN1KMT2A
SCHEMBL5807375 0.69 SIGMAR1 (0.35) SIGMAR1TAAR1SLC18A2
SCHEMBL17479478 0.67 SIGMAR1 (0.50) SIGMAR1TAAR1SLC18A2MEN1KMT2A
SCHEMBL2799200 0.67 EPHX1 (0.42) SIGMAR1TAAR1CYP2D6
SCHEMBL21243273 0.66 SIGMAR1 (0.73) SIGMAR1TAAR1SLC18A2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4346788-A2 ENANTIOMERIC ENTACTOGEN COMPOSITIONS AND METHODS OF THEIR USE Arcadia Medicine, Inc. (US) 2024-04-10 EP claimed
US-20230201160-A1 MDMA TREATMENT TO ENHANCE ACUTE EMOTIONAL EFFECTS PROFILE OF LSD, PSILOCYBIN OR OTHER PSYCHEDELICS UNIVERSITATSSPITAL BASEL (CH) 2023-06-29 US claimed
CN-115811975-A MDMA treatment to enhance the acute emotional response characteristics of LSD, siloxibin, or other hallucinogens 巴塞尔大学医院 2023-03-17 CN claimed
EP-4138815-A1 MDMA TREATMENT TO ENHANCE ACUTE EMOTIONAL EFFECTS PROFILE OF LSD, PSILOCYBIN OR OTHER PSYCHEDELICS Universitätsspital Basel (CH) 2023-03-01 EP claimed
WO-2022256720-A2 ENANTIOMERIC ENTACTOGEN COMPOSITIONS AND METHODS OF THEIR USE ARCADIA MEDICINE, INC. (US) 2022-12-08 WO claimed
US-11364221-B2 MDMA treatment to enhance acute emotional effects profile of LSD, psilocybin or other psychedelics UNIVERSITÄTSSPITAL BASEL (CH) 2022-06-21 US claimed
US-20220096429-A1 MDMA TREATMENT TO ENHANCE ACUTE EMOTIONAL EFFECTS PROFILE OF LSD, PSILOCYBIN OR OTHER PSYCHEDELICS UNIVERSITÄTSSPITAL BASEL (CH) 2022-03-31 US claimed
WO-2021225796-A1 MDMA TREATMENT TO ENHANCE ACUTE EMOTIONAL EFFECTS PROFILE OF LSD, PSILOCYBIN OR OTHER PSYCHEDELICS UNIVERSITÄTSSPITAL BASEL (CH) 2021-11-11 WO claimed
US-20120108510-A1 METHODS OF IMPROVING BEHAVIORAL THERAPIES EMORY UNIVERSITY (US) 2012-05-03 US claimed
EP-1501352-A4 METHODS AND COMPOSITIONS FOR CONTROLLED RELEASE OF DRUGS UNIV WYOMING (US) 2007-03-07 EP claimed
WO-2005039381-A2 COMPOSITIONS AND PROCESSES FOR ANALYSIS OF PHARMACOLOGIC AGENTS IN BIOLOGICAL SAMPLES DRUG RISK SOLUTIONS, L.L.C. (US) 2005-05-06 WO claimed
US-20050037386-A1 Composition and processes for analysis of pharmacologic agents in biological samples DRUG RISK SOLUTIONS, L.L.C. 2005-02-17 US claimed
EP-1501352-A1 METHODS AND COMPOSITIONS FOR CONTROLLED RELEASE OF DRUGS THE UNIVERSITY OF WYOMING (US) 2005-02-02 EP claimed
US-20050002895-A1 Methods and compositions for controlled release of drugs WYOMING, UNIVERSITY OF, THE 2005-01-06 US claimed
WO-2003051113-A1 METHODS AND COMPOSITIONS FOR CONTROLLED RELEASE OF DRUGS THE UNIVERSITY OF WYOMING (US) 2003-06-26 WO claimed
EP-4687880-A1 ADVANTAGEOUS FLUOROBENZOFURANS FOR THE TREATMENT OF MENTAL DISORDERS OR ENHANCEMENT Tactogen Inc. (US) 2026-02-11 EP disclosed
US-20260021069-A1 ADVANTAGEOUS FLUOROBENZOFURANS FOR THE TREATMENT OF MENTAL DISORDERS OR ENHANCEMENT TACTOGEN INC (US) 2026-01-22 US disclosed
EP-1196784-A2 PROCESS FOR THE QUANTITATIVE DETERMINATION OF ALKALOIDS SUCH AS COCAINE IN A SOLID SAMPLE AND REAGENT FOR USE IN SUCH PROCESS Azienda Provinciale Per I Servizi Sanitari (IT) 2002-04-17 EP disclosed
EP-1167976-A2 Immunoassay for the detection of amphetamines and derivatives thereof BOEHRINGER MANNHEIM GMBH (DE) 2002-01-02 EP disclosed
WO-2001006251-A2 PROCESS FOR THE QUANTITATIVE DETERMINATION OF ALKALOIDS SUCH AS COCAINE IN A SOLID SAMPLE AND REAGENT FOR USE IN SUCH PROCESS AZIENDA PROVINCIALE PER I SERVIZI SANITARI (IT) 2001-01-25 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 (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-20050002895-A1 Methods and compositions for controlled release of drugs OPRK1, OPRM1, OPRL1 SIGMAR1 6/4885TAAR1 50/4885SLC18A2 95/4885
US-20260021069-A1 ADVANTAGEOUS FLUOROBENZOFURANS FOR THE TREATMENT OF MENTAL DISORDERS OR ENHANCEMENT HCN1, HCN4, CRH SIGMAR1 821/4885TAAR1 425/4885SLC18A2 113/4885

“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.