SCHEMBL21335487

SCHEMBL21335487

C=C1SCC(O)(c2ccccc2)N1Nc1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ GSK3A P49840 1/20 0.36
▸ GSK3B P49841 1/20 0.36
▸ ALDH1A1 P00352 4/20 0.33
▸ LMNA P02545 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ HTT P42858 1/20 0.33
▸ GRIN2B Q13224 1/20 0.31
▸ KMT2A Q03164 1/20 0.30

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
SCHEMBL17446271 0.82 GSK3A (0.48) GSK3AGSK3BALDH1A1LMNAMAPT
SCHEMBL19116813 0.77 HTT (0.40) GSK3AGSK3BALDH1A1LMNAMAPT
SCHEMBL21335493 0.73 ALDH1A1 (0.40) GSK3AGSK3BALDH1A1LMNAMAPT
SCHEMBL21335483 0.70 GSK3A (0.58) GSK3AGSK3BALDH1A1MAPTKMT2A
SCHEMBL19181360 0.69 LMNA (0.45) GSK3AGSK3BALDH1A1LMNAMAPT
SCHEMBL21335489 0.68 GSK3A (0.41) GSK3AGSK3BALDH1A1
SCHEMBL19116985 0.68 GSK3A (0.46) GSK3AGSK3BALDH1A1
SCHEMBL19147905 0.66 SIGMAR1 (0.47) GSK3AGSK3BGRIN2B
SCHEMBL19147613 0.65 GSK3A (0.49) GSK3AGSK3BALDH1A1LMNAGRIN2B
SCHEMBL19147344 0.65 GSK3A (0.73) GSK3AGSK3BALDH1A1LMNAMAPT

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-10633377-B2 Imidazole and thiazole compositions for modifying biological signaling OHIO UNIVERSITY (US) 2020-04-28 — — US disclosed
US-10407420-B2 Imidazole and thiazole compositions for modifying biological signaling OHIO UNIVERSITY (US) 2019-09-10 — — 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 (2 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-10407420-B2 Imidazole and thiazole compositions for modifying biological signaling TYRO3, FGFR1, STAT6 GSK3A 1263/4885GSK3B 725/4885ALDH1A1 2384/4885
US-10633377-B2 Imidazole and thiazole compositions for modifying biological signaling TYRO3, FGFR1, STAT6 GSK3A 1251/4885GSK3B 724/4885ALDH1A1 2382/4885

“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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