SCHEMBL25817520

SCHEMBL25817520

CN(C)CCn1c2c(c3ncncc31)OCCCO2

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR1D P28221 1/20 0.31
HTR2C P28335 1/20 0.31
TOP2A P11388 1/20 0.30

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
SCHEMBL24109868 0.95 TOP2A (0.32) TOP2A
SCHEMBL24109821 0.87 TDP1 (0.36) TOP2A
SCHEMBL24110026 0.85 HTR1D (0.38) HTR1DHTR2C
SCHEMBL25817505 0.84 HTR2C (0.35) HTR1DHTR2C
SCHEMBL24110650 0.84 HTR2C (0.34) HTR1DHTR2C
SCHEMBL24110465 0.83 HTR2C (0.34) HTR1DHTR2C
SCHEMBL24110598 0.81
SCHEMBL24110453 0.81 HTR6 (0.40) TOP2A
SCHEMBL24110470 0.79 CYP2D6 (0.38) HTR1DHTR2CTOP2A
SCHEMBL24110600 0.77 KDM4E (0.31)

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 2 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

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 HTR1D 47/4885HTR2C 35/4885TOP2A 2088/4885

“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.