SCHEMBL121198

SCHEMBL121198

COc1ccc([C@]2(C#N)CC[C@H](OC(=O)O)CC2)cc1OC1CCCC1

nearest known ligand 0.79

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 20/20 0.79
PDE4A P27815 19/20 0.79
PDE4C Q08493 19/20 0.79
PDE4D Q08499 19/20 0.79

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
SCHEMBL2480497 1.00 PDE4B (0.79) PDE4BPDE4APDE4CPDE4D
SCHEMBL6823878 1.00 PDE4B (0.79) PDE4BPDE4APDE4CPDE4D
SCHEMBL7058059 0.89 PDE4B (0.63) PDE4BPDE4APDE4CPDE4D
SCHEMBL7055428 0.89 PDE4B (0.63) PDE4BPDE4APDE4CPDE4D
Cilomilast SCHEMBL26372 0.88 PDE4B (1.00) PDE4BPDE4APDE4CPDE4D
Cilomilast SCHEMBL5975855 0.88 PDE4B (1.00) PDE4BPDE4APDE4CPDE4D
Cilomilast SCHEMBL13777301 0.88 PDE4B (1.00) PDE4BPDE4APDE4CPDE4D
Cilomilast SCHEMBL27515 0.88 PDE4B (1.00) PDE4BPDE4APDE4CPDE4D
Cilomilast SCHEMBL27516 0.88 PDE4B (1.00) PDE4BPDE4APDE4CPDE4D
Bicarbonate SCHEMBL4603657 0.88 PDE4A (0.80) PDE4BPDE4APDE4CPDE4D

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 130 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1305329-B2 6.ALPHA.,9.ALPHA.-DIFLUORO-17.ALPHA.-(2-FURANYLCARBOXYL)OXY-11.BETA.-HYDROXY-16.ALPHA.-METHYL-3-OXO-ANDROST-1,4-DIENE-17-CARBOTHIOIC ACID S-FLUOROMETHYL ESTER AS AN ANTI-INFLAMMATORY AGENT GLAXO GROUP LTD (GB) 2015-03-18 EP claimed
EP-1305329-B1 6.ALPHA.,9.ALPHA.-DIFLUORO-17.ALPHA.-(2-FURANYLCARBOXYL)OXY-11.BETA.-HYDROXY-16.ALPHA.-METHYL-3-OXO-ANDROST-1,4-DIENE-17-CARBOTHIOIC ACID S-FLUOROMETHYL ESTER AS AN ANTI-INFLAMMATORY AGENT GLAXO GROUP LTD (GB) 2007-12-05 EP claimed
EP-1279662-B1 Process for preparing phenylcyclohexan-1-ylcarboxylic acids SMITHKLINE BEECHAM CORP (US) 2006-08-16 EP claimed
EP-1289557-B1 CANCER TREATMENT COMPOSITION CONTAINING AN ANTI-NEOPLASTIC AGENT AND A PDE4 INHIBITOR GLAXO GROUP LTD (GB) 2006-07-12 EP claimed
EP-1051172-B1 METHOD FOR TREATING COPD SMITHKLINE BEECHAM CORP (US) 2004-12-22 EP claimed
US-20230372297-A1 MEDICAMENTS FOR THE TREATMENT OR PREVENTION OF FIBROTIC DISEASES BOEHRINGER INGELHEIM INT (DE) 2023-11-23 US disclosed
US-20200330435-A1 MEDICAMENTS FOR THE TREATMENT OR PREVENTION OF FIBROTIC DISEASES BOEHRINGER INGELHEIM INT (DE) 2020-10-22 US disclosed
EP-3643309-A1 MEDICAMENTS FOR THE TREATMENT OR PREVENTION OF FIBROTIC DISEASES Boehringer Ingelheim International GmbH (DE) 2020-04-29 EP disclosed
EP-2026761-B1 INHALANT PROPELLANT-FREE AEROSOL FORMULATION BOEHRINGER INGELHEIM INT (DE) 2020-04-15 EP disclosed
EP-2878297-B1 Medicaments for the treatment or prevention of fibrotic diseases BOEHRINGER INGELHEIM INT (DE) 2020-03-25 EP disclosed
CN-106279110-B heterocyclic compounds, medicaments containing said compounds, their use and processes for their preparation 勃林格殷格翰国际有限公司 2019-12-10 CN disclosed
US-20190038600-A1 MEDICAMENTS FOR THE TREATMENT OR PREVENTION OF FIBROTIC DEISEASES BOEHRINGER INGELHEIM INT (DE) 2019-02-07 US disclosed
US-20060154939-A1 Medicaments for the Treatment or Prevention of Fibrotic Diseases BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2006-07-13 US disclosed
US-20060148883-A1 Medicaments for the Treatment or Prevention of Fibrotic Diseases BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2006-07-06 US disclosed
WO-2006067168-A1 MEDICAMENTS FOR THE TREATMENT OR PREVENTION OF FIBROTIC DISEASES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2006-06-29 WO disclosed
US-20060142373-A1 Medicaments for the Treatment or Prevention of Fibrotic Diseases BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2006-06-29 US disclosed
WO-2006067165-A2 INDOLIDONE DERIVATIVES FOR THE TREATMENT OR PREVENTION OF FIBROTIC DISEASES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2006-06-29 WO disclosed
WO-2006045715-A1 BLISTER FOR INHALERS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2006-05-04 WO disclosed
WO-2006037736-A1 NOVEL POWDER INHALATION PREPARATIONS BASED ON MODIFIED LACTOSE BLENDS THAT ARE USED AS ADJUVANTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2006-04-13 WO disclosed
WO-2005102349-A1 PHARMACEUTICAL COMBINATIONS CONTAINING BENZOXAZINE FOR TREATING RESPIRATORY DISEASES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-11-03 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 (6 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-20060148883-A1 Medicaments for the Treatment or Prevention of Fibrotic Diseases COL1A1, MMP1, FOXM1 PDE4B 3219/4885PDE4A 2156/4885PDE4C 2866/4885
US-20060142373-A1 Medicaments for the Treatment or Prevention of Fibrotic Diseases MMP1, COL1A1, FOXM1 PDE4B 2638/4885PDE4A 1781/4885PDE4C 2512/4885
US-20060154939-A1 Medicaments for the Treatment or Prevention of Fibrotic Diseases MMP1, COL1A1, FOXM1 PDE4B 2638/4885PDE4A 1781/4885PDE4C 2512/4885
US-20200330435-A1 MEDICAMENTS FOR THE TREATMENT OR PREVENTION OF FIBROTIC DISEASES MMP1, COL1A1, FOXM1 PDE4B 2638/4885PDE4A 1781/4885PDE4C 2512/4885
US-20230372297-A1 MEDICAMENTS FOR THE TREATMENT OR PREVENTION OF FIBROTIC DISEASES MMP1, COL1A1, SMAD3 PDE4B 2772/4885PDE4A 1965/4885PDE4C 2891/4885
US-20190038600-A1 MEDICAMENTS FOR THE TREATMENT OR PREVENTION OF FIBROTIC DEISEASES MMP1, COL1A1, IDO1 PDE4B 995/4885PDE4A 545/4885PDE4C 876/4885

“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.