SCHEMBL5458715

SCHEMBL5458715

COc1ccc(C2=NOC(C)(C(N)=O)C2)cc1OC1CCCC1

nearest known ligand 0.80

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 17/20 0.80
PDE4B Q07343 15/20 0.80
PDE4C Q08493 15/20 0.80
PDE4D Q08499 15/20 0.80

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
SCHEMBL5470083 0.92 PDE4A (0.80) PDE4APDE4BPDE4CPDE4D
SCHEMBL13031020 0.92 PDE4A (0.80) PDE4APDE4BPDE4CPDE4D
SCHEMBL7444856 0.91 PDE4A (0.81) PDE4APDE4BPDE4CPDE4D
SCHEMBL13031021 0.91 PDE4A (0.78) PDE4APDE4BPDE4CPDE4D
SCHEMBL5740782 0.90 PDE4A (0.74) PDE4APDE4BPDE4CPDE4D
SCHEMBL5475820 0.90 PDE4A (0.84) PDE4APDE4BPDE4CPDE4D
SCHEMBL5471486 0.88 PDE4A (0.71) PDE4APDE4BPDE4CPDE4D
SCHEMBL3541858 0.87 PDE4B (0.73) PDE4APDE4BPDE4CPDE4D
SCHEMBL3551823 0.86 PDE4B (0.72) PDE4APDE4BPDE4CPDE4D
SCHEMBL3549971 0.86 PDE4B (0.72) PDE4APDE4BPDE4CPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070259874-A1 Phosphodiesterase Inhibitors RANBAXY LABORATORIES LIMITED (IN) 2007-11-08 US disclosed
EP-1694655-A2 PHOSPHODIESTERASE INHIBITORS Ranbaxy Laboratories Limited (IN) 2006-08-30 EP disclosed
WO-2005051931-A2 PHOSPHODIESTERASE INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2005-06-09 WO disclosed
US-6114367-A SUCH AS 3-(3-CYCLOPENTYLOXY-4-METHOXY)PHENYL-2-ISOXAZOLINE-5-HYDROXAMIC ACID; TREATING SEPSIS, SEPTIC SHOCK, INFLAMMATORY BOWEL DISEASE, TUBERCULOSIS, GRAFT VERSUS HOST DISEASE OR CACHEXIA ASSOCIATED WITH AIDS OR CANCER IN A MAMMAL PFIZER INC (US) 2000-09-05 US disclosed
US-5869511-A Isoxazoline compounds as inhibitors of TNF release PFIZER INC. (US) 1999-02-09 US disclosed
EP-0749428-B1 ISOXAZOLINE COMPOUNDS AS INHIBITORS OF TNF RELEASE PFIZER (US) 1998-07-29 EP disclosed
US-5716967-A SELECTIVE INHIBITOR OF PHOSPHODIESTERASE TYPE 4, USEFUL IN TREATMENT OF ASTHMA, ARTHRITIS, BRONCHITIS, CHRONIC OBSTRUCTIVE PULMONARY DISEASE, PSORIASIS, ALLERGIC RHINITIS, DERMATITIS OR SHOCK PFIZER INC. (US) 1998-02-10 US disclosed
EP-0730588-B1 ISOXAZOLINE COMPOUNDS AS ANTIINFLAMMATORY AGENTS PFIZER (US) 1997-07-02 EP disclosed
EP-0730588-A1 ISOXAZOLINE COMPOUNDS AS ANTIINFLAMMATORY AGENTS PFIZER (US) 1996-09-11 EP disclosed
WO-1995014681-A1 ISOXAZOLINE COMPOUNDS AS ANTIINFLAMMATORY AGENTS PFIZER INC. (US) 1995-06-01 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-20070259874-A1 Phosphodiesterase Inhibitors PDE4A, PDE3B, PDE7A PDE4A 1/4885PDE4B 4/4885PDE4C 6/4885

“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.