Indole

Indole

SCHEMBL5446222

CC(N)O.c1ccc2[nH]ccc2c1

nearest known ligand 0.68

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.68
CA1 P00915 1/20 0.68
CA2 P00918 1/20 0.68
ITGB2 P05107 1/20 0.68
ICAM1 P05362 1/20 0.68
ITGAL P20701 1/20 0.68
CA4 P22748 1/20 0.68
CA6 P23280 1/20 0.68
AHR P35869 1/20 0.68
ADK P55263 1/20 0.68
NPC1 O15118 1/20 0.40
TYR P14679 1/20 0.39
USP2 O75604 1/20 0.39
GAA P10253 1/20 0.39
ALOX15 P16050 1/20 0.39
RAD51 Q06609 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
F2 P00734 1/20 0.38
PTGS2 P35354 1/20 0.37
ADRA2A P08913 2/20 0.36

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
Indole SCHEMBL9418736 0.85 TRPA1 (0.59) TRPA1CA1CA2ITGB2ICAM1
Indole SCHEMBL2948635 0.85 TRPA1 (0.59) TRPA1CA1CA2ITGB2ICAM1
Indole SCHEMBL27647341 0.85 TRPA1 (0.59) TRPA1CA1CA2ITGB2ICAM1
Indole SCHEMBL6791278 0.85 AHR (0.85) TRPA1CA1CA2ITGB2ICAM1
Indole SCHEMBL15007820 0.85 AHR (0.85) TRPA1CA1CA2ITGB2ICAM1
Indole SCHEMBL8213935 0.85 AHR (0.85) TRPA1CA1CA2ITGB2ICAM1
Indole SCHEMBL28020016 0.85 AHR (0.85) TRPA1CA1CA2ITGB2ICAM1
Indole SCHEMBL2769465 0.85 AHR (0.85) TRPA1CA1CA2ITGB2ICAM1
Indole SCHEMBL28042366 0.85 AHR (0.85) TRPA1CA1CA2ITGB2ICAM1
Indole SCHEMBL27856435 0.85 TRPA1 (0.63) TRPA1CA1CA2ITGB2ICAM1

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-20070073060-A1 Tricycle indole hydroxyethlamine derivatives and their use in the treatment of alzheimer's disease GLAXO GROUP LIMITED (GB) 2007-03-29 US disclosed
CN-1914214-A Tricycle indole hydroxyethlamine derivatives and their use in the treatment of alzheimer's disease GLAXO GROUP LTD (GB) 2007-02-14 CN 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-20070073060-A1 Tricycle indole hydroxyethlamine derivatives and their use in the treatment of alzheimer's disease BACE2, BACE1, APP TRPA1 3263/4885CA1 2612/4885CA2 3337/4885

“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.