SCHEMBL7403259

SCHEMBL7403259

COc1ccc2c(O)c(C(c3cccc(NS(=O)(=O)c4cn(C)cn4)c3)C3CC3)c(=O)oc2c1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
GAA P10253 1/20 0.41
KMT2A Q03164 1/20 0.41
PIK3CG P48736 14/20 0.40
HTR6 P50406 1/20 0.38
PIK3CD O00329 1/20 0.38
HSD17B1 P14061 1/20 0.37
HSD17B2 P37059 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
SCHEMBL7400677 0.91 ROCK2 (0.35) MEN1GAAKMT2APIK3CGHTR6
SCHEMBL7353787 0.81 PARP1 (0.46) GAAHTR6HSD17B1HSD17B2
SCHEMBL7826006 0.80 PARP1 (0.42) GAAHTR6HSD17B1HSD17B2
SCHEMBL7403592 0.78 NQO1 (0.36) MEN1KMT2A
SCHEMBL7444419 0.77 KDM4E (0.41) MEN1GAAKMT2APIK3CGHTR6
SCHEMBL7396533 0.77 KDM4E (0.41) MEN1GAAKMT2APIK3CGHTR6
SCHEMBL30925391 0.77 PARP1 (0.42) MEN1GAAKMT2APIK3CGHTR6
SCHEMBL7354182 0.76 NQO1 (0.42) MEN1KMT2A
SCHEMBL7401557 0.76 PARP1 (0.37) MEN1GAAKMT2APIK3CGHTR6
SCHEMBL7402921 0.76 KDM4E (0.47) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11993590-B2 Pyranone compounds useful to modulate OMA1 protease 712 NORTH INC. (US) 2024-05-28 US claimed
US-20210246125-A1 PYRANONE COMPOUNDS USEFUL TO MODULATE OMA1 PROTEASE 712 NORTH INC. 2021-08-12 US claimed
EP-0758327-A1 PYRANONE COMPOUNDS USEFUL TO TREAT RETROVIRAL INFECTIONS PHARMACIA & UPJOHN COMPANY (US) 1997-02-19 EP claimed
WO-1995030670-A2 PYRANONE COMPOUNDS USEFUL TO TREAT RETROVIRAL INFECTIONS PHARMACIA & UPJOHN COMPANY (US) 1995-11-16 WO claimed
US-6169181-B1 HUMAN IMMUNODEFICIENCY VIRUS PROTEINASE INHIBITORS PHARMACIA & UPJOHN COMPANY 2001-01-02 US disclosed
US-5852195-A Pyranone compounds useful to treat retroviral infections PHARMACIA & UPJOHN COMPANY (US) 1998-12-22 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 (2 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-20210246125-A1 PYRANONE COMPOUNDS USEFUL TO MODULATE OMA1 PROTEASE OPA1, OLA1, PITRM1 MEN1 2900/4885GAA 485/4885KMT2A 4167/4885
US-11993590-B2 Pyranone compounds useful to modulate OMA1 protease OPA1, OLA1, PITRM1 MEN1 2900/4885GAA 485/4885KMT2A 4167/4885

“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.