SCHEMBL24110306

SCHEMBL24110306

COc1c(C)ccc2ccn(CC(C)(C)N(C)C)c12

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ACSS2 Q9NR19 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33

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
SCHEMBL24110326 0.86 TDO2 (0.34) HTR2AHTR2C
SCHEMBL24110300 0.85 HTR2A (0.32) HTR2AHTR2C
SCHEMBL24110287 0.82
SCHEMBL24110285 0.81 HTR2A (0.33) HTR2AHTR2C
SCHEMBL24110292 0.80 HTR2A (0.31) ACSS2HTR2AHTR2C
SCHEMBL24110256 0.78 NR3C1 (0.35) HTR2C
SCHEMBL24110303 0.77 NR3C1 (0.32) HTR2AHTR2C
SCHEMBL24109731 0.77 KDM4E (0.38) HTR2AHTR2C
SCHEMBL24110250 0.77 ADRA2A (0.46) HTR2AHTR2C
SCHEMBL24109975 0.76 FABP4 (0.39) HTR2AHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230219969-A1 ISOTRYPTAMINE PSYCHOPLASTOGENS AND USES THEREOF DELIX THERAPEUTICS, INC. 2023-07-13 US disclosed
US-20230219969-A1 ISOTRYPTAMINE PSYCHOPLASTOGENS AND USES THEREOF DELIX THERAPEUTICS, INC. 2023-07-13 US disclosed
WO-2021252692-A1 ISOTRYPTAMINE PSYCHOPLASTOGENS AND USES THEREOF DELIX THERAPEUTICS, INC. (US) 2021-12-16 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-20230219969-A1 ISOTRYPTAMINE PSYCHOPLASTOGENS AND USES THEREOF GAP43, SLC18A2, PNMT ACSS2 1179/4885HTR2A 10/4885HTR2C 35/4885

“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.