SCHEMBL24908523

SCHEMBL24908523

CCCCC(CC)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
ALOX15 P16050 2/20 0.46
MAPT P10636 2/20 0.46
CYP3A4 P08684 2/20 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
L3MBTL1 Q9Y468 1/20 0.46
GAA P10253 1/20 0.42
CYP1A2 P05177 1/20 0.42
PTPN1 P18031 1/20 0.40
CYSLTR2 Q9NS75 1/20 0.39
CYSLTR1 Q9Y271 1/20 0.39
MYC P01106 1/20 0.39
ASPH Q12797 1/20 0.38
KDM8 Q8N371 1/20 0.38
CA2 P00918 1/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL29788749 0.94 ALDH1A1 (0.44) KDM4EALDH1A1ALOX15MAPTCYP3A4
SCHEMBL24912620 0.91 KDM4E (0.49) KDM4EALDH1A1ALOX15MAPTCYP3A4
SCHEMBL28770590 0.90 CYSLTR2 (0.47) KDM4EALDH1A1ALOX15MAPTCYP3A4
SCHEMBL24912635 0.88 KDM4E (0.55) KDM4EALDH1A1ALOX15MAPTCYP3A4
SCHEMBL28669524 0.83 KDM4E (0.41) KDM4EALDH1A1MAPTCYP3A4PTPN1
SCHEMBL30292533 0.80 L3MBTL1 (0.44) KDM4EALDH1A1MAPTL3MBTL1PTPN1
SCHEMBL30106526 0.80 KDM4E (0.44) KDM4EALDH1A1ALOX15MAPTCYP3A4
SCHEMBL25452695 0.79 PTPN1 (0.42) KDM4EALDH1A1ALOX15MAPTCYP3A4
SCHEMBL5498417 0.78 KDM4E (0.46) KDM4EALDH1A1ALOX15MAPTCYP3A4
SCHEMBL30665068 0.78 CA2 (0.37) KDM4EALDH1A1ALOX15MAPTCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230014445-A1 ALLOSTERIC CHROMENONE INHIBITORS OF PHOSPHOINOSITIDE 3-KINASE (PI3K) FOR THE TREATMENT OF DISEASE LOXO ONCOLOGY, INC. 2023-01-19 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-20230014445-A1 ALLOSTERIC CHROMENONE INHIBITORS OF PHOSPHOINOSITIDE 3-KINASE (PI3K) FOR THE TREATMENT OF DISEASE PIK3CA, PIK3R4, PIK3R5 KDM4E 2710/4885ALDH1A1 3272/4885ALOX15 2909/4885

“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.