SCHEMBL5770609

SCHEMBL5770609

CCN(CC)CCc1c[nH]c2cccc(OCc3ccccc3)c12

nearest known ligand 0.78

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 6/20 0.78
HTR1D P28221 3/20 0.60
HTR1A P08908 3/20 0.58
HTR6 P50406 2/20 0.53
BCHE P06276 5/20 0.50
HTR2C P28335 1/20 0.46
HTR2B P41595 1/20 0.46
TRPM8 Q7Z2W7 2/20 0.46
TRPV1 Q8NER1 1/20 0.45

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
SCHEMBL25029866 0.94 HTR2A (0.73) HTR2AHTR1DHTR1AHTR6BCHE
SCHEMBL23805249 0.89 HTR2A (0.80) HTR2AHTR1DHTR1AHTR6BCHE
SCHEMBL12558834 0.88 HTR2A (1.00) HTR2AHTR1DHTR1AHTR6HTR2C
SCHEMBL29511892 0.88 HTR2A (1.00) HTR2AHTR1DHTR1AHTR6HTR2C
SCHEMBL23805214 0.86 HTR2A (0.79) HTR2AHTR1DHTR1AHTR6BCHE
SCHEMBL23723405 0.85 HTR2A (0.84) HTR2AHTR1DHTR1AHTR6HTR2C
SCHEMBL4206922 0.85 HTR2A (0.77) HTR2AHTR1DHTR1AHTR6HTR2C
SCHEMBL23805277 0.84 HTR2A (0.79) HTR2AHTR1DHTR1AHTR6HTR2C
Hydrochloric Acid SCHEMBL31390111 0.83 HTR2A (0.77) HTR2AHTR1DHTR1AHTR6HTR2C
SCHEMBL4225704 0.82 HTR6 (0.75) HTR2AHTR1DHTR1AHTR6HTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230140635-A1 3-(2-(Aminoethyl)-Indol-4-ol Derivatives, Methods of Preparation Thereof, and the Use as 5-HT2 Receptor Modulators BRIGHT MINDS BIOSCIENCES INC. (CA) 2023-05-04 US disclosed
US-20230140635-A1 3-(2-(Aminoethyl)-Indol-4-ol Derivatives, Methods of Preparation Thereof, and the Use as 5-HT2 Receptor Modulators BRIGHT MINDS BIOSCIENCES INC. (CA) 2023-05-04 US disclosed
US-20230140635-A1 3-(2-(Aminoethyl)-Indol-4-ol Derivatives, Methods of Preparation Thereof, and the Use as 5-HT2 Receptor Modulators BRIGHT MINDS BIOSCIENCES INC. (CA) 2023-05-04 US disclosed
EP-4118071-A1 3-(2-(AMINOETHYL)-INDOL-4-OL DERIVATIVES, METHODS OF PREPARATION THEREOF, AND THE USE AS 5-HT2 RECEPTOR MODULATORS Bright Minds Biosciences Inc. (CA) 2023-01-18 EP disclosed
WO-2021179091-A1 3-(2-(AMINOETHYL)-INDOL-4-OL DERIVATIVES, METHODS OF PREPARATION THEREOF, AND THE USE AS 5-HT2 RECEPTOR MODULATORS BRIGHT MINDS BIOSCIENCES INC. (CA) 2021-09-16 WO disclosed
WO-2021179091-A1 3-(2-(AMINOETHYL)-INDOL-4-OL DERIVATIVES, METHODS OF PREPARATION THEREOF, AND THE USE AS 5-HT2 RECEPTOR MODULATORS BRIGHT MINDS BIOSCIENCES INC. (CA) 2021-09-16 WO disclosed
EP-1509515-A4 SUBSTITUTED 4-ARYL-4H-PYRROLO 2,3-H CHROMENES AND ANALOGS AS ACTIVATORS OF CASPASES AND INDUCERS OF APOPTOSIS AND THE USE THEREOF CYTOVIA INC (US) 2006-07-05 EP disclosed
EP-1509515-A2 SUBSTITUTED 4-ARYL-4H-PYRROLO 2,3-H CHROMENES AND ANALOGS AS ACTIVATORS OF CASPASES AND INDUCERS OF APOPTOSIS AND THE USE THEREOF Cytovia, Inc. (US) 2005-03-02 EP disclosed
WO-2003097806-A2 SUBSTITUTED 4-ARYL-4H-PYRROLO[2,3-H]CHROMENES AND ANALOGS AS ACTIVATORS OF CASPASES AND INDUCERS OF APOPTOSIS AND THE USE THEREOF CYTOVIA, INC. (US) 2003-11-27 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 (1 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-20230140635-A1 3-(2-(Aminoethyl)-Indol-4-ol Derivatives, Methods of Preparation Thereof, and the Use as 5-HT2 Receptor Modulators HTR2C, HTR2A, HTR2B HTR2A 2/4885HTR1D 16/4885HTR1A 9/4885

“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.