SCHEMBL12308073

SCHEMBL12308073

CC(=O)NC(CS[S+](C)[O-])C(=O)SCF

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PAM P19021 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ THRB P10828 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ NFKB1 P19838 1/20 0.32
▸ PTGS2 P35354 1/20 0.32
▸ THPO P40225 1/20 0.32
▸ RECQL P46063 1/20 0.32
▸ BLM P54132 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.31

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
SCHEMBL2463624 0.80 PAM (0.39) PAMKDM4EMAPTTHRBALOX15
SCHEMBL2466567 0.79 PAM (0.38) PAMKDM4EMAPTTHRBALOX15
SCHEMBL2429383 0.74 KDM4E (0.36) PAMKDM4EMAPTTHRBALOX15
SCHEMBL2429387 0.73 PAM (0.37) PAMKDM4EMAPTTHRBALOX15
SCHEMBL2466079 0.67 PAM (0.46) PAM
SCHEMBL14789044 0.64 PAM (0.39) PAMKDM4EMAPTTHRBALOX15
SCHEMBL29475246 0.61 KDM4E (0.38) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL13179780 0.60 PAM (0.36) PAMKDM4EMAPTTHRBALOX15
SCHEMBL22612669 0.60 SMN1; SMN2 (0.50) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL3792833 0.60 SMN1; SMN2 (0.50) KDM4EMAPTTHRBALOX15NFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8815905-B2 Propionic acids, propionic acid esters, and related compounds PROMENTIS PHARMACEUTICALS, INC. (US) 2014-08-26 — — US disclosed
US-8815905-B2 Propionic acids, propionic acid esters, and related compounds PROMENTIS PHARMACEUTICALS, INC. (US) 2014-08-26 — — US disclosed
US-20110224156-A1 Propionic Acids, Propionic Acid Esters, and Related Compounds ALBANY MOLECULAR RESEARCH, INC. 2011-09-15 — — US disclosed
US-20110224156-A1 Propionic Acids, Propionic Acid Esters, and Related Compounds ALBANY MOLECULAR RESEARCH, INC. 2011-09-15 — — 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-20110224156-A1 Propionic Acids, Propionic Acid Esters, and Related Compounds PCCA, PC, PMP22 PAM 1904/4885KDM4E 3640/4885MAPT 165/4885

“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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