SCHEMBL7799770

SCHEMBL7799770

C1CC2CC1O2.COc1ccc(C(CC(=O)NO)N2C(=O)c3ccccc3C2=O)cc1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TNF P01375 8/20 0.60
PDE4A P27815 6/20 0.47
PDE4B Q07343 6/20 0.47
PDE4C Q08493 6/20 0.47
PDE4D Q08499 6/20 0.47
MAPT P10636 4/20 0.44
KMT2A Q03164 1/20 0.44
ATM Q13315 1/20 0.44
TP53 P04637 1/20 0.44

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
SCHEMBL6693277 0.78 TNF (0.77) TNFPDE4APDE4BPDE4CPDE4D
SCHEMBL6371914 0.78 TNF (0.44) TNFPDE4APDE4BPDE4CPDE4D
SCHEMBL7748783 0.78 TNF (0.62) TNFPDE4APDE4BPDE4CPDE4D
SCHEMBL6693845 0.77 TNF (0.79) TNFPDE4APDE4BPDE4CPDE4D
SCHEMBL6688763 0.76 TNF (1.00) TNFPDE4APDE4BPDE4CPDE4D
SCHEMBL4920643 0.76 MAPT (0.61) MAPTKMT2ATP53
SCHEMBL4850938 0.76 MAPT (0.59) MAPTKMT2ATP53
SCHEMBL1194027 0.76 TNF (0.83) TNFPDE4APDE4BPDE4CPDE4D
SCHEMBL825522 0.74 PDE4A (0.82) TNFPDE4APDE4BPDE4CPDE4D
SCHEMBL28722625 0.73 TNF (0.72) TNFPDE4APDE4BPDE4CPDE4D

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-20010049371-A1 Method of inhibiting phosphodiesterases with substituted alkanohydroxamic acids CALGENE CORPORATION 2001-12-06 US claimed

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-20010049371-A1 Method of inhibiting phosphodiesterases with substituted alkanohydroxamic acids PDE3A, PDE2A, PDE3B TNF 8/4885PDE4A 6/4885PDE4B 15/4885

“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.