SCHEMBL21801678

SCHEMBL21801678

COc1ccc(CSc2nnc(-c3[nH]c4ccc(Cl)cc4c3C)o2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.54
▸ HTT P42858 3/20 0.50
▸ TSHR P16473 2/20 0.50
▸ MAPK1 P28482 2/20 0.50
▸ ATM Q13315 1/20 0.50
▸ HSD17B10 Q99714 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.50
▸ GSK3B P49841 4/20 0.49
▸ GSK3A P49840 3/20 0.49
▸ PIK3CB P42338 1/20 0.48
▸ AURKA O14965 1/20 0.47
▸ CSNK1E P49674 1/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ PIK3CD O00329 1/20 0.46
▸ EGFR P00533 1/20 0.46
▸ TERT O14746 1/20 0.46
▸ CNR1 P21554 1/20 0.46
▸ ALDH1A1 P00352 2/20 0.43

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
SCHEMBL21801696 0.90 MAPT (0.50) MAPTHTTMAPK1TDP1MEN1
SCHEMBL21801554 0.89 MAPT (0.52) MAPTHTTTSHRMAPK1ATM
SCHEMBL21801461 0.88 MAPK1 (0.50) MAPTHTTTSHRMAPK1ATM
SCHEMBL21801525 0.88 MAPT (0.53) MAPTTSHRMAPK1TDP1MEN1
SCHEMBL24750370 0.85 MAPT (0.46) MAPTHTTMAPK1TDP1GSK3B
SCHEMBL21801494 0.79 MAPT (0.48) MAPTHTTMAPK1TDP1MEN1
SCHEMBL21801498 0.79 GSK3B (0.46) MAPTTSHRMAPK1TDP1GSK3B
SCHEMBL21801469 0.77 GSK3B (0.48) MAPTHTTTSHRMAPK1ATM
SCHEMBL21801479 0.77 QPCT (0.48) MAPTTSHRMAPK1TDP1GSK3B
SCHEMBL21801466 0.76 MAPT (0.51) MAPTMAPK1TDP1MEN1KMT2A

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-20220257569-A1 INDOLE-OXADIAZOLE COMPOUNDS AND THEIR THERAPEUTIC USE THE GOVERNING COUNCIL OF THE UNIVERSITY OF TORONTO (CA) 2022-08-18 — — US disclosed
WO-2020051707-A1 INDOLE-OXADIAZOLE COMPOUNDS AND THEIR THERAPEUTIC USE THE GOVERNING COUNCIL OF THE UNIVERSITY OF TORONTO (CA) 2020-03-19 — — WO 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-20220257569-A1 INDOLE-OXADIAZOLE COMPOUNDS AND THEIR THERAPEUTIC USE CNR2, GPR119, CNR1 MAPT 2269/4885HTT 3755/4885TSHR 615/4885

“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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