SCHEMBL3494028

SCHEMBL3494028

O=S(=O)(Cc1nnc(-c2ccc3c(c2)CCO3)o1)c1cccc(F)c1

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 13/20 0.66
▸ QPCT Q16769 1/20 0.44
▸ METAP2 P50579 1/20 0.43
▸ NPC1 O15118 2/20 0.43
▸ RAB9A P51151 2/20 0.43
▸ MAPT P10636 1/20 0.43
▸ MAOA P21397 1/20 0.39
▸ MAOB P27338 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ PTGES2 Q9H7Z7 1/20 0.39

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
SCHEMBL3492535 0.79 GSK3B (1.00) GSK3BQPCTMETAP2NPC1RAB9A
SCHEMBL3491254 0.78 GSK3B (1.00) GSK3BNPC1RAB9AMAPT
SCHEMBL3492383 0.78 GSK3B (0.68) GSK3BQPCTMETAP2NPC1RAB9A
SCHEMBL3493961 0.78 GSK3B (0.68) GSK3BMETAP2NPC1RAB9AMAPT
SCHEMBL3492866 0.76 GSK3B (0.66) GSK3BMETAP2NPC1RAB9AMAPT
SCHEMBL3491930 0.73 GSK3B (0.61) GSK3BNPC1RAB9AMAPT
SCHEMBL3491210 0.71 GSK3B (1.00) GSK3BQPCTNPC1RAB9AMAPT
SCHEMBL3493208 0.71 GSK3B (1.00) GSK3B
SCHEMBL3490598 0.71 GSK3B (0.68) GSK3BMETAP2NPC1RAB9AMAPT
SCHEMBL3491221 0.70 GSK3B (0.60) GSK3B

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-8492378-B2 GSK-3β inhibitor TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-07-23 — — US disclosed
US-20100069381-A1 GSK-3BETAINHIBITOR TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-03-18 — — 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 (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-20100069381-A1 GSK-3BETAINHIBITOR GSK3B, GSK3A, GSKIP GSK3B 1/4885QPCT 1905/4885METAP2 2188/4885

“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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