SCHEMBL18818920

SCHEMBL18818920

CNC(=O)C(S)CC(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 2/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ LMNA P02545 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ PTGS2 P35354 1/20 0.45
▸ BMP1 P13497 3/20 0.42
▸ MME P08473 1/20 0.38
▸ ACE P12821 1/20 0.38
▸ CPA1 P15085 1/20 0.38
▸ ACE2 Q9BYF1 1/20 0.38
▸ SLC22A6 Q4U2R8 1/20 0.36
▸ MMP2 P08253 5/20 0.36
▸ MMP3 P08254 5/20 0.36
▸ MMP1 P03956 3/20 0.36
▸ MMP7 P09237 1/20 0.36
▸ RNPEP Q9H4A4 1/20 0.34
▸ FOLH1 Q04609 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ ANPEP P15144 1/20 0.33
▸ ENPEP Q07075 1/20 0.33

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
SCHEMBL24761154 0.81 ALDH1A1 (0.40) TDP1ALDH1A1LMNAMAPTPTGS2
SCHEMBL24259829 0.78 SLC22A6 (0.43) TDP1ALDH1A1LMNAMAPTPTGS2
SCHEMBL26742365 0.77 ALDH1A1 (0.47) TDP1ALDH1A1LMNAMAPTPTGS2
SCHEMBL5471418 0.77 MAPT (0.39) TDP1ALDH1A1LMNAMAPTPTGS2
SCHEMBL5463831 0.77 MAPT (0.39) TDP1ALDH1A1LMNAMAPTPTGS2
SCHEMBL27075331 0.76 LMNA (0.40) TDP1ALDH1A1LMNAMAPTPTGS2
SCHEMBL24806529 0.76 ALDH1A1 (0.32) TDP1ALDH1A1LMNAMAPTPTGS2
SCHEMBL29060619 0.75 — —
SCHEMBL5465868 0.74 RNPEP (0.54) TDP1ALDH1A1LMNAMAPTPTGS2
SCHEMBL5456370 0.74 RNPEP (0.48) TDP1ALDH1A1LMNAMAPTPTGS2

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-10668167-B2 Glucocorticoid receptor agonist and immunoconjugates thereof ABBVIE INC. (US) 2020-06-02 — — US disclosed
US-20190262465-A1 GLUCOCORTICOID RECEPTOR AGONIST AND IMMUNOCONJUGATES THEREOF ABBVIE INC. (US) 2019-08-29 — — US disclosed
WO-2017072662-A1 ANTIBODY CONJUGATES COMPRISING TOLL-LIKE RECEPTOR AGONIST NOVARTIS AG (CH) 2017-05-04 — — WO 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-10668167-B2 Glucocorticoid receptor agonist and immunoconjugates thereof NR3C1, NR3C2, MC2R TDP1 3874/4885ALDH1A1 3434/4885LMNA 4822/4885
US-20190262465-A1 GLUCOCORTICOID RECEPTOR AGONIST AND IMMUNOCONJUGATES THEREOF NR3C1, NR3C2, MC2R TDP1 3874/4885ALDH1A1 3434/4885LMNA 4822/4885

“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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