SCHEMBL13596173

SCHEMBL13596173

CCOc1ccccc1NC(=O)C(C)C

nearest known ligand 0.78

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.78
KDM4E B2RXH2 2/20 0.78
L3MBTL1 Q9Y468 1/20 0.78
GAA P10253 4/20 0.67
LMNA P02545 4/20 0.61
ALDH1A1 P00352 4/20 0.61
NPSR1 Q6W5P4 2/20 0.61
POLB P06746 1/20 0.61
CYP2C19 P33261 1/20 0.60
MEN1 O00255 3/20 0.59
TSHR P16473 1/20 0.59
NPC1 O15118 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
MCL1 Q07820 1/20 0.57
MAPT P10636 2/20 0.57
HPGD P15428 1/20 0.56
MAPK1 P28482 1/20 0.56
UBE2N P61088 1/20 0.56

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
SCHEMBL6358600 0.89 KMT2A (0.76) KMT2AKDM4EL3MBTL1GAALMNA
SCHEMBL31351354 0.88 KMT2A (1.00) KMT2AKDM4EL3MBTL1GAALMNA
SCHEMBL9297476 0.86 KMT2A (0.75) KMT2AKDM4EL3MBTL1GAALMNA
SCHEMBL28529941 0.84 KMT2A (0.74) KMT2AKDM4EL3MBTL1GAALMNA
SCHEMBL8110954 0.83 GAA (0.75) KMT2AKDM4EL3MBTL1GAALMNA
SCHEMBL31527868 0.81 GAA (0.73) KMT2AKDM4EL3MBTL1GAALMNA
SCHEMBL2835288 0.81 GAA (0.73) KMT2AKDM4EL3MBTL1GAALMNA
SCHEMBL9312776 0.81 GAA (0.84) KMT2AKDM4EL3MBTL1GAALMNA
SCHEMBL1791238 0.81 GAA (0.73) KMT2AKDM4EL3MBTL1GAALMNA
SCHEMBL1645837 0.81 GAA (0.73) KMT2AKDM4EL3MBTL1GAALMNA

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-11827640-B2 Substituted pyrazolo[1,5-a]pyrimidines as CFTR modulators ILDONG PHARMACEUTICAL CO., LTD. (KR) 2023-11-28 US disclosed
US-11827640-B2 Substituted pyrazolo[1,5-a]pyrimidines as CFTR modulators ILDONG PHARMACEUTICAL CO., LTD. (KR) 2023-11-28 US disclosed
US-7638526-B2 Azetidine derivatives useful in treating pain, diabetes and disorders of lipid metabolism SCHERING CORPORATION (US) 2009-12-29 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-11827640-B2 Substituted pyrazolo[1,5-a]pyrimidines as CFTR modulators PDE4A, PDE4B, PDE5A KMT2A 4505/4885KDM4E 2287/4885L3MBTL1 4857/4885

“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.