SCHEMBL5905221

SCHEMBL5905221

COc1cc(C(CC(N)=O)N2C(=O)c3cc4ccccc4cc3C2=O)ccc1OC1CCCC1

nearest known ligand 0.82

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 9/20 0.82
PDE4B Q07343 9/20 0.82
PDE4C Q08493 9/20 0.82
PDE4D Q08499 9/20 0.82
TNF P01375 13/20 0.68

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
SCHEMBL5905255 0.99 PDE4A (0.81) PDE4APDE4BPDE4CPDE4DTNF
SCHEMBL5905460 0.98 PDE4A (0.79) PDE4APDE4BPDE4CPDE4DTNF
SCHEMBL844824 0.97 PDE4A (0.87) PDE4APDE4BPDE4CPDE4DTNF
SCHEMBL5905454 0.93 PDE4A (0.77) PDE4APDE4BPDE4CPDE4DTNF
SCHEMBL5905181 0.91 PDE4A (0.71) PDE4APDE4BPDE4CPDE4DTNF
SCHEMBL5905151 0.91 PDE4A (0.79) PDE4APDE4BPDE4CPDE4DTNF
Cdc-801 SCHEMBL185853 0.91 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DTNF
Cdc-801 SCHEMBL29360102 0.91 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DTNF
Cdc-801 SCHEMBL9977552 0.91 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DTNF
SCHEMBL5905134 0.90 PDE4A (0.70) PDE4APDE4BPDE4CPDE4DTNF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060264477-A1 Methods of using cyclic amides MULLER GEORGE W 2006-11-23 US disclosed
US-7081464-B2 Topical compositions of cyclic amides as immunotherapeutic agents CELGENE CORPORATION (US) 2006-07-25 US disclosed
US-20060003979-A1 Topical compositions of cyclic amides as immunotherapeutic agents CELGENE CORPORATION 2006-01-05 US disclosed
US-20050096355-A1 Novel immunotherapeutic agents MULLER GEORGE W (US) 2005-05-05 US disclosed
US-20030114516-A1 Novel immunotherapeutic agents MULLER GEORGE W (US) 2003-06-19 US disclosed
US-6518281-B2 Heterocyclic amides/imides as inhibitors of tumor necrosis factor alpha and nuclear factor kappa B and phosphodi-esterases III and IV; used to combat cachexia, endotoxic shock, retrovirus replication and asthma; antiinflammatory CELGENE CORPORATION 2003-02-11 US disclosed
US-20020002188-A1 Novel immunotherapeutic agents MULLER GEORGE W (US) 2002-01-03 US disclosed
US-6180644-B1 TUMOR NECROSIS FACTOR INHIBITOR; ANTIINFLAMMATORY AGENT CELGENE CORPORATION 2001-01-30 US disclosed
US-5968945-A Immunotherapeutic agents CELGENE CORPORATION (US) 1999-10-19 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 (5 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-20050096355-A1 Novel immunotherapeutic agents STING1, RNASE1, CGAS PDE4A 8/4885PDE4B 15/4885PDE4C 12/4885
US-20020002188-A1 Novel immunotherapeutic agents STING1, RNASE1, CGAS PDE4A 7/4885PDE4B 13/4885PDE4C 8/4885
US-20030114516-A1 Novel immunotherapeutic agents STING1, RNASE1, CGAS PDE4A 7/4885PDE4B 13/4885PDE4C 8/4885
US-20060003979-A1 Topical compositions of cyclic amides as immunotherapeutic agents TSLP, STING1, CGAS PDE4A 8/4885PDE4B 21/4885PDE4C 6/4885
US-20060264477-A1 Methods of using cyclic amides RNASE1, RNGTT, CGAS PDE4A 5/4885PDE4B 10/4885PDE4C 7/4885

“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.