SCHEMBL7026709

SCHEMBL7026709

COc1ccc(Cn2c(N)c(NC(=O)C(C)C)c(=O)[nH]c2=S)cc1OC1CCCC1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 17/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ USP2 O75604 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ PDE4A P27815 6/20 0.40
▸ PDE4C Q08493 6/20 0.40
▸ PDE4D Q08499 6/20 0.40
▸ GAA P10253 1/20 0.40
▸ POLB P06746 1/20 0.39

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
SCHEMBL7088560 0.92 KDM4E (0.50) PDE4BKDM4EUSP2ALDH1A1MAPT
SCHEMBL6672335 0.90 MAPT (0.49) KDM4EUSP2ALDH1A1MAPTHPGD
SCHEMBL6673141 0.88 PDE4B (0.44) PDE4BKDM4EUSP2ALDH1A1MAPT
SCHEMBL8409717 0.87 KDM4E (0.46) PDE4BKDM4EUSP2ALDH1A1MAPT
SCHEMBL6673366 0.83 PDE4B (0.48) PDE4BPDE4APDE4CPDE4DGAA
SCHEMBL6673781 0.83 ALDH1A1 (0.49) KDM4EUSP2ALDH1A1MAPTHPGD
SCHEMBL6677308 0.83 PDE4A (0.42) PDE4BKDM4EUSP2ALDH1A1MAPT
SCHEMBL6675416 0.83 KDM4E (0.43) PDE4BKDM4EUSP2ALDH1A1MAPT
SCHEMBL6673809 0.82 PDE4B (0.39) PDE4BKDM4EUSP2ALDH1A1MAPT
SCHEMBL7319925 0.81 KDM4E (0.61) KDM4EUSP2ALDH1A1MAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0916673-B1 6-Amino purine derivatives having PDE-IV inhibition activity EURO CELTIQUE SA (LU) 2003-01-29 — — EP disclosed
US-6413975-B1 DISEASES WITH HIGH LEVELS OF INFLAMMATORY CYTOKINES; ASTHMA; ALLERGIES; INFLAMMATION; DEPRESSION; ALZHEIMER'S DISEASE; VASCULAR AND MULTI-IN-FARCT DEMENTIA EURO-CELTIQUE, S.A. (LU) 2002-07-02 — — US disclosed
US-6319928-B1 ASTHMA, ALLERGIES, INFLAMMATION,DEPRESSION, DEMENTIA, ALZHEIMER'S DISEASE, VASCULAR AND MULTI-IN-FARCT DEMENTIA AND DISEASE CAUSED BY HUMAN IMMUNODEFICIENCY VIRUS TREATMENT; EFFICIENCY AND SELECTIVITY EURO-CELTIQUE, S.A. (LU) 2001-11-20 — — US disclosed
US-6294541-B1 ENZYME INHIBITORS USING PURINE COMPOUNDS AS ANTIHISTAMINES EURO-CELTIQUE S.A. (LU) 2001-09-25 — — US disclosed
EP-0705265-B1 NOVEL CHEMICAL COMPOUNDS HAVING PDE-IV INHIBITION ACTIVITY EURO CELTIQUE SA (LU) 1999-07-28 — — EP disclosed
EP-0916672-A1 6-Amino purine derivatives having PDE-IV inhibition activity and intermediates Euroceltique S.A. (LU) 1999-05-19 — — EP disclosed
EP-0916673-A1 6-Amino purine derivatives having PDE-IV inhibition activity Euroceltique S.A. (LU) 1999-05-19 — — EP disclosed
WO-1995000516-A1 NOVEL CHEMICAL COMPOUNDS HAVING PDE-IV INHIBITION ACTIVITY EURO-CELTIQUE S.A. (LU) 1995-01-05 — — WO disclosed
Send feedback