SCHEMBL25463533

SCHEMBL25463533

CNC(=O)COc1ccc2ccccc2c1C(C)=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NCEH1 Q6PIU2 2/20 0.57
HPGD P15428 3/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
PRNP P04156 5/20 0.49
RXFP1 Q9HBX9 2/20 0.49
LMNA P02545 2/20 0.49
OGG1 O15527 1/20 0.49
PKM P14618 1/20 0.48
CTSD P07339 2/20 0.47
ALDH1A1 P00352 5/20 0.47
KMT2A Q03164 3/20 0.45
POLB P06746 2/20 0.45
MEN1 O00255 2/20 0.45
MAPT P10636 2/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2C19 P33261 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
KDM4E B2RXH2 2/20 0.43
TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL4539589 0.81 ALDH1A1 (0.60) NCEH1LMNAALDH1A1KDM4E
SCHEMBL6846901 0.81 OGG1 (0.72) HPGDSMN1; SMN2LMNAOGG1ALDH1A1
SCHEMBL2560822 0.80 L3MBTL1 (0.59) HPGDSMN1; SMN2PRNPRXFP1LMNA
SCHEMBL13209662 0.78 NCEH1 (0.57) NCEH1HPGDLMNACTSDALDH1A1
SCHEMBL18494105 0.77 GAA (0.59) NCEH1ALDH1A1TDP1KCNH2
SCHEMBL13209884 0.77 NCEH1 (0.56) NCEH1HPGDLMNACTSDALDH1A1
SCHEMBL4531027 0.77 CA9 (0.64) NCEH1HPGDSMN1; SMN2LMNACTSD
SCHEMBL13210145 0.77 NCEH1 (0.56) NCEH1HPGDSMN1; SMN2LMNACTSD
SCHEMBL29843665 0.77 RAPGEF3 (0.49) NCEH1HPGDSMN1; SMN2PRNPRXFP1
SCHEMBL23843604 0.77 RAPGEF3 (0.49) NCEH1HPGDSMN1; SMN2PRNPRXFP1

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-20230150929-A1 SELECTIVE NON-CYCLIC NUCLEOTIDE ACTIVATORS FOR THE CAMP SENSOR EPAC1 UNIV TEXAS (US) 2023-05-18 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-20230150929-A1 SELECTIVE NON-CYCLIC NUCLEOTIDE ACTIVATORS FOR THE CAMP SENSOR EPAC1 CREB1, RAPGEF4, ATF4 NCEH1 1848/4885HPGD 1544/4885SMN1; SMN2 4027/4885

“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.