SCHEMBL24543402

SCHEMBL24543402

CC(C)(C)NC(=O)[C@@H](N)C(C)(C)O

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ SPHK1 Q9NYA1 1/20 0.37
▸ POLB P06746 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ PTGS1 P23219 1/20 0.34
▸ DPP4 P27487 1/20 0.34
▸ EPHX1 P07099 1/20 0.32
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ ARG1 P05089 1/20 0.30
▸ ARG2 P78540 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
SCHEMBL9962281 0.83 DPP4 (0.48) POLBALDH1A1MAPTPTGS1DPP4
SCHEMBL4956469 0.83 DPP4 (0.48) POLBALDH1A1MAPTPTGS1DPP4
SCHEMBL19964616 0.79 POLB (0.34) POLBALDH1A1MAPTPTGS1DPP4
SCHEMBL3416457 0.78 SPHK1 (0.41) SPHK1ALDH1A1MAPTPTGS1DPP4
SCHEMBL3258317 0.77 POLB (0.39) POLBALDH1A1MAPTPTGS1DPP4
SCHEMBL12234218 0.75 DPP4 (0.43) POLBALDH1A1MAPTPTGS1DPP4
SCHEMBL13164141 0.75 DPP4 (0.43) POLBALDH1A1MAPTPTGS1DPP4
SCHEMBL24543407 0.75 DPP4 (0.43) POLBALDH1A1MAPTPTGS1DPP4
SCHEMBL21661368 0.74 DPP4 (0.46) SPHK1POLBALDH1A1MAPTPTGS1
SCHEMBL8473624 0.73 POLB (0.37) POLBALDH1A1MAPTPTGS1DPP4

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-20220194939-A1 Novel compounds and methods of use treating fructose-related disorders or diseases NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2022-06-23 — — 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-20220194939-A1 Novel compounds and methods of use treating fructose-related disorders or diseases GCK, KHK, HK1 SPHK1 71/4885POLB 3687/4885ALDH1A1 1628/4885

“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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