SCHEMBL24933559

SCHEMBL24933559

OCc1cncc(C2CC2)c1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 6/20 0.39
CYP11B1 P15538 3/20 0.39
NOS3 P29474 1/20 0.38
NOS1 P29475 1/20 0.38
CYP2A6 P11509 1/20 0.37
KDM4E B2RXH2 1/20 0.34
PRMT5 O14744 1/20 0.33
WDR77 Q9BQA1 1/20 0.33
CYP19A1 P11511 1/20 0.33
ESR1 P03372 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
ESR2 Q92731 1/20 0.32
PRKCI P41743 1/20 0.32
DGAT1 O75907 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
SCHEMBL17820615 0.92 CYP11B2 (0.42) CYP11B2CYP11B1NOS3NOS1CYP2A6
SCHEMBL30240861 0.81 CYP11B2 (0.39) CYP11B2CYP11B1NOS3NOS1CYP2A6
SCHEMBL24933003 0.81 CYP11B2 (0.39) CYP11B2CYP11B1NOS3NOS1CYP2A6
SCHEMBL14157219 0.80 NOS3 (0.38) CYP11B2NOS3NOS1KDM4EPRMT5
SCHEMBL13015538 0.80 CHRNB2 (0.43) CYP11B2NOS3NOS1PRMT5WDR77
SCHEMBL2350483 0.80 PRMT5 (0.41) CYP11B2NOS3NOS1PRMT5WDR77
SCHEMBL16962311 0.78 ACHE (0.42) KDM4EESR1CYP3A4CYP2C9ESR2
SCHEMBL29960198 0.76 KDM4E (0.38) KDM4EESR1CYP3A4CYP2C9ESR2
SCHEMBL17819789 0.75 CYP11B1 (0.34) CYP11B2CYP11B1CYP2A6ESR2
SCHEMBL2728918 0.75 CYP2A6 (0.47) CYP11B2CYP11B1CYP2A6KDM4EPRMT5

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-20240360082-A1 SUBSTITUTED PYRIDONE COMPOUNDS USEFUL TO TREAT ORTHOMYXOVIRUS INFECTIONS NOVARTIS AG (CH) 2024-10-31 US disclosed
EP-4373809-A1 SUBSTITUTED PYRIDONE COMPOUNDS USEFUL TO TREAT ORTHOMYXOVIRUS INFECTIONS Novartis AG (CH) 2024-05-29 EP disclosed
CN-117980292-A Substituted pyridone compounds for the treatment of orthomyxoviral infections 诺华股份有限公司 2024-05-03 CN disclosed
WO-2023002443-A1 SUBSTITUTED PYRIDONE COMPOUNDS USEFUL TO TREAT ORTHOMYXOVIRUS INFECTIONS NOVARTIS AG (CH) 2023-01-26 WO disclosed
WO-2023002443-A1 SUBSTITUTED PYRIDONE COMPOUNDS USEFUL TO TREAT ORTHOMYXOVIRUS INFECTIONS NOVARTIS AG (CH) 2023-01-26 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 (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-20240360082-A1 SUBSTITUTED PYRIDONE COMPOUNDS USEFUL TO TREAT ORTHOMYXOVIRUS INFECTIONS PNPO, PDXK, PLPBP CYP11B2 1174/4885CYP11B1 1109/4885NOS3 3262/4885

“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.