SCHEMBL14066339

SCHEMBL14066339

CSC[C@H](NC(C)=O)C(C)=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ THRB P10828 1/20 0.45
▸ ALOX15 P16050 1/20 0.45
▸ NFKB1 P19838 1/20 0.45
▸ PTGS2 P35354 1/20 0.45
▸ THPO P40225 1/20 0.45
▸ RECQL P46063 1/20 0.45
▸ BLM P54132 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ ALDH1A1 P00352 3/20 0.43
▸ REN P00797 3/20 0.38
▸ MTNR1A P48039 3/20 0.35
▸ MTNR1B P49286 3/20 0.35
▸ PAM P19021 1/20 0.34
▸ FOLH1 Q04609 1/20 0.33
▸ CHRM2 P08172 1/20 0.32
▸ CHRM4 P08173 1/20 0.32
▸ CHRM1 P11229 1/20 0.32
▸ GNPAT O15228 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
SCHEMBL12931595 1.00 MAPT (0.45) MAPTKDM4ETHRBALOX15NFKB1
SCHEMBL11112209 0.86 MAPT (0.42) MAPTKDM4ETHRBALOX15NFKB1
SCHEMBL11113212 0.86 MAPT (0.42) MAPTKDM4ETHRBALOX15NFKB1
SCHEMBL6658481 0.84 MAPT (0.59) MAPTKDM4ETHRBALOX15NFKB1
SCHEMBL4952983 0.84 MAPT (0.59) MAPTKDM4ETHRBALOX15NFKB1
SCHEMBL13921443 0.84 MAPT (0.59) MAPTKDM4ETHRBALOX15NFKB1
SCHEMBL25449141 0.82 TGFBR1 (0.34) ALDH1A1FOLH1
SCHEMBL10564990 0.82 MAPT (0.42) MAPTKDM4ETHRBALOX15NFKB1
SCHEMBL15281201 0.80 MAPT (0.41) MAPTKDM4ETHRBALOX15NFKB1
SCHEMBL9688310 0.80 GAA (0.42) MAPTKDM4ETHRBALOX15NFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180071367-A1 METHODS OF TREATING COGNITIVE IMPAIRMENTS OR DYSFUNCTION OXEIA BIOPHARMACEUTICALS, INC. (US) 2018-03-15 — — US disclosed
US-20170281732-A1 METHODS OF TREATING MILD BRAIN INJURY OXEIA BIOPHARMACEUTICALS, INC. (US) 2017-10-05 — — US disclosed
US-20170266257-A1 METHODS OF TREATING TRAUMATIC BRAIN INJURY OXEIA BIOPHARMACEUTICALS, INC. (US) 2017-09-21 — — US disclosed
US-20170121385-A1 METHODS OF TREATING NEURODEGENERATIVE CONDITIONS OXEIA BIOPHARMACEUTICALS, INC. (US) 2017-05-04 — — US disclosed
US-20170121385-A1 METHODS OF TREATING NEURODEGENERATIVE CONDITIONS OXEIA BIOPHARMACEUTICALS, INC. (US) 2017-05-04 — — US disclosed
US-20080234283-A1 Glutathione peroxidase mimetics for treatment of neurodegenerative, pulmonary and inflammatory diseases RAPPAPORT FAMILY INSTITUTE FOR RESEARCH IN THE MEDICAL SCIENCES (IL) 2008-09-25 — — US disclosed
US-20080213785-A1 Method of predicting a benefit of antioxidant therapy for prevention or treatment of vasclar disease in hyperglycemic individuals BBDX, INC. 2008-09-04 — — US disclosed
US-20080207679-A1 Glutathione peroxidase mimetics for the treatment of dermatoses BERKOWITZ NOAH 2008-08-28 — — 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 (6 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-20170266257-A1 METHODS OF TREATING TRAUMATIC BRAIN INJURY ATP6V1B2, FABP7, GHSR MAPT 1278/4885KDM4E 1960/4885THRB 587/4885
US-20080234283-A1 Glutathione peroxidase mimetics for treatment of neurodegenerative, pulmonary and inflammatory diseases GPX1, GPX4, MPO MAPT 461/4885KDM4E 4377/4885THRB 4283/4885
US-20080207679-A1 Glutathione peroxidase mimetics for the treatment of dermatoses GPX1, GPX4, GGT1 MAPT 3190/4885KDM4E 3673/4885THRB 4573/4885
US-20170121385-A1 METHODS OF TREATING NEURODEGENERATIVE CONDITIONS HTT, SNCA, NLN MAPT 31/4885KDM4E 3300/4885THRB 1142/4885
US-20180071367-A1 METHODS OF TREATING COGNITIVE IMPAIRMENTS OR DYSFUNCTION CRH, PYGB, CHAT MAPT 354/4885KDM4E 2743/4885THRB 450/4885
US-20170281732-A1 METHODS OF TREATING MILD BRAIN INJURY ATP6V1B2, GHSR, CRH MAPT 799/4885KDM4E 1949/4885THRB 1026/4885

“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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