SCHEMBL6097146

SCHEMBL6097146

COc1ccc2c(c1)O[C@H](CO)CN2C

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 2/20 0.44
HRH3 Q9Y5N1 2/20 0.42
PTGIR P43119 2/20 0.41
MTNR1A P48039 1/20 0.39
TP53 P04637 1/20 0.38
MAPT P10636 1/20 0.38
POLB P06746 1/20 0.38
HTR3E A5X5Y0 1/20 0.38
HTR3B O95264 1/20 0.38
HTR3A P46098 1/20 0.38
HTR3D Q70Z44 1/20 0.38
HTR3C Q8WXA8 1/20 0.38
THRB P10828 1/20 0.36
PTGDR Q13258 1/20 0.35

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
SCHEMBL6101073 0.90 NISCH (0.51) NISCHHRH3PTGIRMTNR1ATP53
SCHEMBL14367875 0.86 NISCH (0.44) NISCHHRH3PTGIRMTNR1APOLB
SCHEMBL14367859 0.86 NISCH (0.44) NISCHHRH3PTGIRMTNR1APOLB
SCHEMBL10855238 0.84 HRH3 (0.39) NISCHHRH3MTNR1ATP53MAPT
SCHEMBL5645322 0.81 NISCH (0.50) NISCHPTGIRTP53MAPT
SCHEMBL6101300 0.80 HTR1A (0.44) NISCHPTGIRPTGDR
SCHEMBL6978896 0.80 HTR1A (0.47) NISCHHRH3PTGIRTP53MAPT
SCHEMBL10855230 0.80 HRH3 (0.47) HRH3MTNR1ATP53MAPTPOLB
SCHEMBL6102026 0.77 CASR (0.49) NISCHPTGIR
SCHEMBL731248 0.77 CASR (0.49) NISCHPTGIR

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-7153852-B2 Indole compounds, process for producing the same and drugs containing the same as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2006-12-26 US disclosed
US-20050004096-A1 Indole derivatives, process for producing the same and drugs containing the same as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2005-01-06 US disclosed
EP-1424325-A1 INDOLE DERIVATIVES, PROCESS FOR PRODUCING THE SAME AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2004-06-02 EP 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-20050004096-A1 Indole derivatives, process for producing the same and drugs containing the same as the active ingredient IDO1, IDO2, PTGIR NISCH 1449/4885HRH3 187/4885PTGIR 3/4885

“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.