SCHEMBL5498417

SCHEMBL5498417

CCCC(C)c1cccnc1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.46
ALDH1A1 P00352 4/20 0.46
MAPT P10636 2/20 0.46
ALOX15 P16050 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
CYP3A4 P08684 1/20 0.46
TSHR P16473 1/20 0.46
BLM P54132 1/20 0.46
AGER Q15109 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
CYP1A2 P05177 2/20 0.45
GAA P10253 1/20 0.42
MYC P01106 1/20 0.42
ASPH Q12797 2/20 0.37
KDM8 Q8N371 2/20 0.37
CTSA P10619 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
KMT2A Q03164 2/20 0.35
PTPN1 P18031 1/20 0.35
NPC1 O15118 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
SCHEMBL25452695 0.88 PTPN1 (0.42) KDM4EALDH1A1MAPTALOX15L3MBTL1
SCHEMBL24908450 0.87 KDM4E (0.49) KDM4EALDH1A1MAPTALOX15L3MBTL1
Trifluoroacetic Acid SCHEMBL30437577 0.84 MLYCD (0.38) KDM4EALDH1A1MAPTALOX15L3MBTL1
SCHEMBL24912620 0.83 KDM4E (0.49) KDM4EALDH1A1MAPTALOX15L3MBTL1
SCHEMBL10094225 0.80 KDM4E (0.55) KDM4EALDH1A1MAPTALOX15L3MBTL1
SCHEMBL24912635 0.79 KDM4E (0.55) KDM4EALDH1A1MAPTALOX15L3MBTL1
SCHEMBL14354346 0.78 KDM4E (0.53) KDM4EALDH1A1MAPTALOX15L3MBTL1
SCHEMBL24908523 0.78 KDM4E (0.46) KDM4EALDH1A1MAPTALOX15L3MBTL1
SCHEMBL20509034 0.78 KDM4E (0.49) KDM4EALDH1A1MAPTALOX15L3MBTL1
SCHEMBL27958570 0.77 KDM4E (0.52) KDM4EALDH1A1MAPTALOX15L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11873295-B2 Allosteric chromenone inhibitors of phosphoinositide 3-kinase (PI3K) for the treatment of disease PETRA PHARMA CORPORATION (US) 2024-01-16 US disclosed
US-20230014445-A1 ALLOSTERIC CHROMENONE INHIBITORS OF PHOSPHOINOSITIDE 3-KINASE (PI3K) FOR THE TREATMENT OF DISEASE LOXO ONCOLOGY, INC. 2023-01-19 US disclosed
US-20230017140-A1 ALLOSTERIC CHROMENONE INHIBITORS OF PHOSPHOINOSITIDE 3-KINASE (PI3K) FOR THE TREATMENT OF DISEASE LOXO ONCOLOGY, INC. 2023-01-19 US disclosed
EP-1824822-A2 NOVEL 4-AMINOPIPERIDINE DERIVATIVES AS PLASMEPSIN II INHIBITORS Actelion Pharmaceuticals Ltd. (CH) 2007-08-29 EP disclosed
WO-2006056930-A2 NOVEL 4 -AMINOPIPERIDINE DERIVATIVES AS PLASMEPSIN II INHIBITORS ACTELION PHARMACEUTICALS LTD (CH) 2006-06-01 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 (3 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-11873295-B2 Allosteric chromenone inhibitors of phosphoinositide 3-kinase (PI3K) for the treatment of disease PIK3CA, PIK3R4, PIK3R5 KDM4E 2656/4885ALDH1A1 3412/4885MAPT 3441/4885
US-20230017140-A1 ALLOSTERIC CHROMENONE INHIBITORS OF PHOSPHOINOSITIDE 3-KINASE (PI3K) FOR THE TREATMENT OF DISEASE PIK3CA, PIK3R4, PIK3R5 KDM4E 2656/4885ALDH1A1 3412/4885MAPT 3441/4885
US-20230014445-A1 ALLOSTERIC CHROMENONE INHIBITORS OF PHOSPHOINOSITIDE 3-KINASE (PI3K) FOR THE TREATMENT OF DISEASE PIK3CA, PIK3R4, PIK3R5 KDM4E 2710/4885ALDH1A1 3272/4885MAPT 3652/4885

“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.