SCHEMBL32676785

SCHEMBL32676785

CN1Cc2cccc(Cl)c2C[C@H]1CN

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADRA2A P08913 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ ADRA2B P18089 1/20 0.41
▸ ADRA2C P18825 1/20 0.41
▸ ADRA1D P25100 1/20 0.41
▸ ADRA1A P35348 1/20 0.41
▸ ADRA1B P35368 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ CTSD P07339 1/20 0.37
▸ ACHE P22303 1/20 0.36
▸ DRD2 P14416 2/20 0.34
▸ DRD3 P35462 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ NAMPT P43490 1/20 0.34
▸ AADAT Q8N5Z0 2/20 0.33
▸ ACACB O00763 1/20 0.33
▸ HTR2A P28223 1/20 0.33
▸ HTR2C P28335 1/20 0.33
▸ HTR2B P41595 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
SCHEMBL32677026 1.00 ADRA2A (0.41) ADRA2ACYP2D6ADRA2BADRA2CADRA1D
SCHEMBL32677131 1.00 ADRA2A (0.41) ADRA2ACYP2D6ADRA2BADRA2CADRA1D
SCHEMBL32676876 0.83 HTR1A (0.37) DRD2AADATHTR2AHTR2CHTR2B
SCHEMBL32677184 0.83 HTR1A (0.37) DRD2AADATHTR2AHTR2CHTR2B
SCHEMBL32676664 0.83 HTR1A (0.37) DRD2AADATHTR2AHTR2CHTR2B
SCHEMBL32676691 0.82 CXCR4 (0.35) ACACBCXCR4
SCHEMBL32676685 0.82 CXCR4 (0.35) ACACBCXCR4
SCHEMBL32676840 0.82 CXCR4 (0.35) ACACBCXCR4
SCHEMBL32676862 0.77 OPRM1 (0.48) CYP2D6CYP1A2HTR2AHTR2CCXCR4
SCHEMBL32676674 0.77 OPRM1 (0.48) CYP2D6CYP1A2HTR2AHTR2CCXCR4

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-20260049060-A1 TETRAHYDROISOQUINOLINYLMETHYLBENZAMIDE COMPOUNDS NATIONAL HEALTH RES INST (TW) 2026-02-19 — — 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-20260049060-A1 TETRAHYDROISOQUINOLINYLMETHYLBENZAMIDE COMPOUNDS OPRK1, OPRD1, OPRM1 ADRA2A 216/4885CYP2D6 41/4885ADRA2B 238/4885

“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.

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