SCHEMBL7164089

SCHEMBL7164089

CC(C)(C)OC(=O)Nc1ccc(C(=O)NC2N=C(c3ccccc3)c3cc(N)cc4c3N(CC4)C2=O)cc1

nearest known ligand 0.75

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 20/20 0.75
PDE4B Q07343 20/20 0.75
PDE4C Q08493 20/20 0.75
PDE4D Q08499 20/20 0.75
PDE3B Q13370 16/20 0.75
PDE3A Q14432 16/20 0.75
PDE5A O76074 11/20 0.75
PDE1A P54750 11/20 0.75
PDE1B Q01064 11/20 0.75
PDE1C Q14123 11/20 0.75

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
SCHEMBL7164092 1.00 PDE4A (0.75) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7159233 0.86 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7159230 0.86 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7159568 0.85 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL6051289 0.85 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7160159 0.83 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL5607953 0.83 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7156583 0.80 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL3805902 0.79 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL6441242 0.79 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DPDE3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6544983-B2 Administering 3,4,6,7-tetrahydro-(1,4)diazepino(6,7,1-hi)indol-3-yl)-benzamide or nicotamide or isonicotamide or carboxamide derivatives for treatment of chronic obstructive pulmonary disease PFIZER INC 2003-04-08 US claimed
US-20020010175-A1 Diazepinoindoles for the treatment of chronic obstructive pulmonary disease DOHERTY ANNETTE (FR) 2002-01-24 US claimed
EP-0828742-B1 DIAZEPINO-INDOLES AS PHOSPHODIESTERASE IV INHIBITORS JOUVEINAL INST RECH (FR) 2001-12-19 EP claimed
EP-1161950-A1 Use of diazepinoindoles for the treatment of chronic obstructive pulmonary disease WARNER-LAMBERT COMPANY (US) 2001-12-12 EP claimed
EP-1161949-A1 Use od diazepinoindoles for the treatment of chronic obstructive pulmonary disease WARNER-LAMBERT COMPANY (US) 2001-12-12 EP claimed
US-6544983-B2 Administering 3,4,6,7-tetrahydro-(1,4)diazepino(6,7,1-hi)indol-3-yl)-benzamide or nicotamide or isonicotamide or carboxamide derivatives for treatment of chronic obstructive pulmonary disease PFIZER INC 2003-04-08 US disclosed
EP-1199074-A1 Pharmaceutical composition for preventing or treating a disease associated with an excess of il-12 production WARNER-LAMBERT COMPANY (US) 2002-04-24 EP disclosed
EP-1188438-A1 Pharmaceutical composition for preventing or treating a disease associated with an excess of Il-12 production WARNER-LAMBERT COMPANY (US) 2002-03-20 EP disclosed
US-20020010175-A1 Diazepinoindoles for the treatment of chronic obstructive pulmonary disease DOHERTY ANNETTE (FR) 2002-01-24 US disclosed
EP-1161949-A1 Use od diazepinoindoles for the treatment of chronic obstructive pulmonary disease WARNER-LAMBERT COMPANY (US) 2001-12-12 EP disclosed
EP-1161950-A1 Use of diazepinoindoles for the treatment of chronic obstructive pulmonary disease WARNER-LAMBERT COMPANY (US) 2001-12-12 EP disclosed
US-5972927-A ANTIINFLAMMATORY, ANTIALLERGIC AND BRONCHODILATORY MEDICINAL PRODUCTS, TREATMENT OF ASTHMA JOUVEINAL (FR) 1999-10-26 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 (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-20020010175-A1 Diazepinoindoles for the treatment of chronic obstructive pulmonary disease CYP11B2, CYP11B1, ADRB2 PDE4A 1163/4885PDE4B 980/4885PDE4C 1806/4885

“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.