SCHEMBL24660447

SCHEMBL24660447

Cc1nn(C2CCOCC2)cc1C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.45
JAK1 P23458 1/20 0.45
TYK2 P29597 1/20 0.45
CFTR P13569 2/20 0.39
SPR P35270 2/20 0.38
LRRK2 Q5S007 1/20 0.38
IRAK4 Q9NWZ3 10/20 0.38
NOTUM Q6P988 1/20 0.36
IRAK1 P51617 2/20 0.36

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
SCHEMBL20551867 0.89 NOTUM (0.45) JAK2JAK1TYK2NOTUM
SCHEMBL22637662 0.84 IRAK4 (0.46) JAK2JAK1TYK2SPRLRRK2
SCHEMBL23289669 0.82 JAK2 (0.42) JAK2JAK1TYK2CFTRIRAK4
SCHEMBL20552487 0.78 TGFBR1 (0.39) JAK2JAK1TYK2
SCHEMBL18012432 0.77 LRRK2 (0.43) JAK2JAK1TYK2LRRK2IRAK4
SCHEMBL17619401 0.76 KDM4C (0.53) LRRK2IRAK4
SCHEMBL26029500 0.76 MGLL (0.39) JAK2JAK1TYK2LRRK2NOTUM
SCHEMBL5122723 0.75 ABL1 (0.38) NOTUM
SCHEMBL5021087 0.74 LRRK2 (0.41) JAK2JAK1TYK2LRRK2IRAK4
SCHEMBL25067443 0.74 LRRK2 (0.41) JAK2JAK1TYK2LRRK2IRAK4

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220259193-A1 KCNT1 INHIBITORS AND METHODS OF USE PRAXIS PRECISION MEDICINES, INC. (US) 2022-08-18 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-20220259193-A1 KCNT1 INHIBITORS AND METHODS OF USE KCNT1, KCNT2, KCNQ2 JAK2 4092/4885JAK1 4250/4885TYK2 4677/4885

“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.