SCHEMBL29624261

SCHEMBL29624261

C=CCOC(=O)CCCSC[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SLC17A5 Q9NRA2 1/20 0.49
▸ MDM4 O15151 2/20 0.46
▸ TP53 P04637 2/20 0.46
▸ CASP1 P29466 2/20 0.45
▸ TLR2 O60603 2/20 0.44
▸ CASP3 P42574 2/20 0.44
▸ TNF P01375 3/20 0.43
▸ KMT2A Q03164 1/20 0.42
▸ MDM2 Q00987 4/20 0.42

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
SCHEMBL5060938 0.89 KMT2A (0.51) SLC17A5MDM4TP53CASP1CASP3
SCHEMBL29456972 0.88 SLC17A5 (0.51) SLC17A5MDM4TP53TLR2CASP3
SCHEMBL31398346 0.88 MDM2 (0.51) MDM4TP53CASP1TLR2CASP3
SCHEMBL31398353 0.88 MDM2 (0.51) MDM4TP53CASP1TLR2CASP3
SCHEMBL25358998 0.88 MDM2 (0.51) MDM4TP53CASP1TLR2CASP3
SCHEMBL29407853 0.88 MDM4 (0.51) SLC17A5MDM4TP53CASP1TLR2
SCHEMBL119481 0.88 MDM4 (0.51) SLC17A5MDM4TP53CASP1TLR2
SCHEMBL30055069 0.88 MDM4 (0.51) SLC17A5MDM4TP53CASP1TLR2
SCHEMBL29376536 0.88 MDM4 (0.51) SLC17A5MDM4TP53CASP1TLR2
SCHEMBL178741 0.88 MDM4 (0.51) SLC17A5MDM4TP53CASP1TLR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240066132-A1 NOVEL FATTY ACIDS AND THEIR USE IN CONJUGATION TO BIOMOLECULES NOVARTIS AG (CH) 2024-02-29 — — US disclosed
US-11752211-B2 Fatty acids and their use in conjugation to biomolecules NOVARTIS AG (CH) 2023-09-12 — — US disclosed
EP-3988170-A1 FATTY ACIDS AND THEIR USE IN CONJUGATION TO BIOMOLECULES Novartis AG (CH) 2022-04-27 — — EP 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-20240066132-A1 NOVEL FATTY ACIDS AND THEIR USE IN CONJUGATION TO BIOMOLECULES FABP1, FABP2, FABP3 SLC17A5 1079/4885MDM4 4731/4885TP53 4462/4885
US-11752211-B2 Fatty acids and their use in conjugation to biomolecules FABP1, FABP2, FABP3 SLC17A5 1130/4885MDM4 4725/4885TP53 4349/4885

“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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