SCHEMBL24710487

SCHEMBL24710487

O=C(O)C(=O)NC1CCC(F)(F)CC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.49
SMN1; SMN2 Q16637 4/20 0.41
NPC1 O15118 3/20 0.41
RAB9A P51151 2/20 0.41
MAPT P10636 1/20 0.41
KDM1A O60341 6/20 0.38
NAMPT P43490 1/20 0.36
CNR1 P21554 1/20 0.36
MAOB P27338 4/20 0.35
MAPK1 P28482 1/20 0.35
DUSP3 P51452 1/20 0.35
PTPN5 P54829 1/20 0.35
PTPN11 Q06124 1/20 0.35
MAOA P21397 2/20 0.35
CD38 P28907 1/20 0.35
HSD11B1 P28845 1/20 0.35
CHRM2 P08172 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL2772737 0.83 EPHX2 (0.51) EPHX2KDM1ANAMPTCNR1MAOB
SCHEMBL583921 0.79
SCHEMBL29223315 0.78 APLNR (0.36) SMN1; SMN2NPC1RAB9AMAPTKDM1A
SCHEMBL2224304 0.77 EPHX2 (0.50) EPHX2KDM1ANAMPTCNR1MAOB
SCHEMBL12437203 0.77 EPHX2 (0.59) EPHX2KDM1ANAMPTCNR1MAOB
SCHEMBL23573493 0.76 EPHX2 (0.46) EPHX2KDM1ANAMPTCNR1MAOB
SCHEMBL23573492 0.76 EPHX2 (0.46) EPHX2KDM1ANAMPTCNR1MAOB
SCHEMBL23195090 0.76 NPC1 (0.48) EPHX2SMN1; SMN2NPC1RAB9AMAPT
SCHEMBL5026796 0.75 SMN1; SMN2 (0.64) EPHX2SMN1; SMN2NPC1RAB9AMAPT
SCHEMBL9456557 0.75 SMN1; SMN2 (0.71) EPHX2SMN1; SMN2NPC1RAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117794896-A Protease inhibitors for the treatment of coronavirus infections 斯克里普斯研究学院 2024-03-29 CN disclosed
US-11708348-B2 Protease inhibitors for treatment of coronavirus infections THE SCRIPPS RESEARCH INSTITUTE (US) 2023-07-25 US disclosed
US-11708348-B2 Protease inhibitors for treatment of coronavirus infections THE SCRIPPS RESEARCH INSTITUTE (US) 2023-07-25 US disclosed
US-20230033285-A1 Protease Inhibitors for Treatment of Coronavirus Infections THE SCRIPPS RESEARCH INSTITUTE 2023-02-02 US disclosed
US-20230024012-A1 Protease Inhibitors for Treatment of Coronavirus Infections THE SCRIPPS RESEARCH INSTITUTE 2023-01-26 US disclosed
WO-2022266363-A1 PROTEASE INHIBITORS FOR THE TREATMENT OF CORONAVIRUS INFECTIONS THE SCRIPPS RESEARCH INSTITUTE (US) 2022-12-22 WO disclosed
WO-2022266363-A1 PROTEASE INHIBITORS FOR THE TREATMENT OF CORONAVIRUS INFECTIONS THE SCRIPPS RESEARCH INSTITUTE (US) 2022-12-22 WO disclosed
WO-2022261473-A1 PROTEASE INHIBITORS FOR THE TREATMENT OF CORONAVIRUS INFECTIONS THE SCRIPPS RESEARCH INSTITUTE (US) 2022-12-15 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 (3 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-20230024012-A1 Protease Inhibitors for Treatment of Coronavirus Infections ACE, ACE2, TMPRSS2 EPHX2 2636/4885SMN1; SMN2 3769/4885NPC1 792/4885
US-11708348-B2 Protease inhibitors for treatment of coronavirus infections ACE, ACE2, TMPRSS2 EPHX2 2636/4885SMN1; SMN2 3769/4885NPC1 792/4885
US-20230033285-A1 Protease Inhibitors for Treatment of Coronavirus Infections ACE, ACE2, TMPRSS2 EPHX2 2636/4885SMN1; SMN2 3769/4885NPC1 792/4885

“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.