SCHEMBL25818067

SCHEMBL25818067

CN[C@H](C)Cn1ccc2cc(C)cnc21

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 11/20 0.38
HTR2C P28335 11/20 0.38
CCR1 P32246 1/20 0.35
CCR5 P51681 1/20 0.35
CCR8 P51685 1/20 0.35
HTR2B P41595 9/20 0.34
PSMD14 O00487 1/20 0.33
COPS5 Q92905 1/20 0.33
CYP1A2 P05177 1/20 0.33
GLO1 Q04760 1/20 0.31

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
SCHEMBL25818065 0.82 HTR2C (0.57) HTR2AHTR2CHTR2BCYP1A2
SCHEMBL25300885 0.82 HTR2C (0.43) HTR2AHTR2CHTR2BGLO1
SCHEMBL30404903 0.82 HTR2C (0.43) HTR2AHTR2CHTR2BGLO1
SCHEMBL24110211 0.82 HTR2C (0.43) HTR2AHTR2CHTR2BGLO1
SCHEMBL25818036 0.80 HTR2A (0.38) HTR2AHTR2CCCR1CCR5CCR8
SCHEMBL21704227 0.77 CCR1 (0.42) HTR2AHTR2CCCR1CCR5CCR8
SCHEMBL25818070 0.75 HTR2C (0.42) HTR2AHTR2CHTR2BCYP1A2
SCHEMBL15339570 0.73 CCR1 (0.39) CCR1CCR5CCR8CYP1A2GLO1
SCHEMBL24110216 0.72 HTR2C (0.44) HTR2AHTR2CHTR2BCYP1A2
SCHEMBL30404414 0.72 HTR2C (0.44) HTR2AHTR2CHTR2BCYP1A2

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 1 patent. 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

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 HTR2A 10/4885HTR2C 35/4885CCR1 3870/4885

“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.