SCHEMBL29894943

SCHEMBL29894943

Cn1cncc1-c1ccc(NC(=O)[C@@H](NC(=O)OC(C)(C)C)C2Cc3ccccc3C2)cc1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 4/20 0.42
▸ GPR119 Q8TDV5 1/20 0.42
▸ AAK1 Q2M2I8 2/20 0.38
▸ JAK2 O60674 2/20 0.37
▸ BCL2 P10415 2/20 0.37
▸ CYP17A1 P05093 2/20 0.36
▸ DRD2 P14416 1/20 0.36
▸ LIPE Q05469 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ NAMPT P43490 3/20 0.36
▸ BECN1 Q14457 1/20 0.36
▸ SCN9A Q15858 1/20 0.35

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
SCHEMBL28604647 0.89 GPR119 (0.46) IDO1GPR119AAK1JAK2MEN1
SCHEMBL28607177 0.89 GPR119 (0.46) IDO1GPR119AAK1JAK2CYP17A1
SCHEMBL28604646 0.89 GPR119 (0.46) IDO1GPR119AAK1JAK2MEN1
SCHEMBL28614617 0.88 GPR119 (0.45) IDO1GPR119AAK1MEN1KMT2A
SCHEMBL28617686 0.80 IDO1 (0.38) IDO1GPR119JAK2BCL2CYP17A1
SCHEMBL28605926 0.80 MEN1 (0.46) IDO1GPR119AAK1JAK2CYP17A1
SCHEMBL28603103 0.80 IDO1 (0.41) IDO1GPR119AAK1JAK2BCL2
SCHEMBL22125838 0.79 IDO1 (0.41) IDO1GPR119JAK2BCL2CYP17A1
SCHEMBL28602379 0.79 GPR119 (0.44) IDO1GPR119JAK2CYP17A1MEN1
SCHEMBL28609015 0.79 HDAC8 (0.53) BCL2SCN9A

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-11377425-B1 Small molecule modulators of IL-17 LEO PHARMA A/S (DK) 2022-07-05 — — 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-11377425-B1 Small molecule modulators of IL-17 IL17A, IL15, IL2 IDO1 594/4885GPR119 2796/4885AAK1 2606/4885

“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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