SCHEMBL21801461

SCHEMBL21801461

Cc1c(-c2nnc(SCc3ccc(F)cc3)o2)[nH]c2ccc(Cl)cc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 3/20 0.50
▸ HPGD P15428 3/20 0.50
▸ NPC1 O15118 3/20 0.50
▸ TDP1 Q9NUW8 3/20 0.50
▸ HSD17B10 Q99714 1/20 0.50
▸ MAPT P10636 5/20 0.48
▸ MEN1 O00255 3/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ NPSR1 Q6W5P4 2/20 0.48
▸ SMN1; SMN2 Q16637 3/20 0.47
▸ RAB9A P51151 3/20 0.47
▸ TSHR P16473 1/20 0.47
▸ HTT P42858 2/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ GSK3A P49840 1/20 0.47
▸ GSK3B P49841 1/20 0.47
▸ NCOA1 Q15788 1/20 0.47
▸ NCOA3 Q9Y6Q9 1/20 0.47
▸ QPCT Q16769 2/20 0.47
▸ PIK3CD O00329 1/20 0.45

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 0.92 MAPT (0.50) MAPK1HPGDNPC1TDP1MAPT
SCHEMBL21801525 0.90 MAPT (0.53) MAPK1HPGDNPC1TDP1MAPT
SCHEMBL21801678 0.88 MAPT (0.54) MAPK1NPC1TDP1HSD17B10MAPT
SCHEMBL24750370 0.87 MAPT (0.46) MAPK1HPGDTDP1MAPTMEN1
SCHEMBL21801494 0.81 MAPT (0.48) MAPK1HPGDNPC1TDP1MAPT
SCHEMBL21801498 0.80 GSK3B (0.46) MAPK1HPGDNPC1TDP1MAPT
SCHEMBL21801479 0.78 QPCT (0.48) MAPK1HPGDNPC1TDP1MAPT
SCHEMBL21801466 0.78 MAPT (0.51) MAPK1HPGDNPC1TDP1MAPT
SCHEMBL24750432 0.77 NPC1 (0.51) MAPK1HPGDNPC1TDP1MAPT
SCHEMBL21801554 0.77 MAPT (0.52) MAPK1NPC1TDP1HSD17B10MAPT

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 MAPK1 2968/4885HPGD 1456/4885NPC1 504/4885

“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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