SCHEMBL4637716

SCHEMBL4637716

COc1ccc(C=O)cc1OC1CC2CCC1CC2

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.55
TSHR P16473 1/20 0.55
PDE4A P27815 12/20 0.53
PDE4B Q07343 12/20 0.53
PDE4C Q08493 12/20 0.53
PDE4D Q08499 12/20 0.53
PDE3B Q13370 1/20 0.53
PDE3A Q14432 1/20 0.53
FDPS P14324 1/20 0.46
AOX1 Q06278 1/20 0.44
TRIM24 O15164 1/20 0.44
HPGD P15428 1/20 0.44
ALDH5A1 P51649 1/20 0.44
ABAT P80404 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
TRIM33 Q9UPN9 1/20 0.44
TTR P02766 1/20 0.43

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
SCHEMBL7278320 0.93 PDE4B (0.60) ALDH1A1TSHRPDE4APDE4BPDE4C
SCHEMBL7288403 0.93 PDE4B (0.60) ALDH1A1TSHRPDE4APDE4BPDE4C
SCHEMBL7278324 0.93 PDE4B (0.60) ALDH1A1TSHRPDE4APDE4BPDE4C
SCHEMBL7270844 0.93 PDE4B (0.60) ALDH1A1TSHRPDE4APDE4BPDE4C
SCHEMBL4637207 0.93 PDE4B (0.60) ALDH1A1TSHRPDE4APDE4BPDE4C
SCHEMBL4637257 0.91 ALDH1A1 (0.54) ALDH1A1TSHRPDE4APDE4BPDE4C
SCHEMBL9376359 0.78 ALDH1A1 (0.55) ALDH1A1TSHRPDE4BPDE3AFDPS
SCHEMBL22713946 0.78 ALDH1A1 (0.68) ALDH1A1TSHRPDE4APDE4BPDE4C
SCHEMBL9377078 0.78 ALDH1A1 (0.51) ALDH1A1TSHRPDE4APDE4BPDE4C
SCHEMBL7358878 0.78 ALDH1A1 (0.51) ALDH1A1TSHRPDE4APDE4BPDE4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1468991-B1 Imides as PDE III, PDE IV and TNF inhibitors CELGENE CORP (US) 2008-02-20 EP disclosed
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
EP-1468991-A1 Imides as PDE III, PDE IV and TNF inhibitors CELGENE CORPORATION (US) 2004-10-20 EP disclosed
EP-0874819-B1 IMIDES AS PDE III, PDE IV AND TNF INHIBITORS CELGENE CORP (US) 2004-05-26 EP 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-5968945-A Immunotherapeutic agents CELGENE CORPORATION (US) 1999-10-19 US disclosed
EP-0874819-A1 IMIDES AS PDE III, PDE IV AND TNF INHIBITORS CELGENE CORPORATION (US) 1998-11-04 EP disclosed
WO-1997023457-A1 IMIDES AS PDE III, PDE IV AND TNF INHIBITORS CELGENE CORPORATION (US) 1997-07-03 WO disclosed
US-5459145-A Calcium independent camp phosphodiesterase inhibitor antidepressant PFIZER INC. (US) 1995-10-17 US disclosed
US-5294730-A A-Amino-4-alkoxy-3-polycycloalkyloxybenzyl cyanide derivatives PFIZER INC. (US) 1994-03-15 US disclosed
EP-0247725-B1 Calcium independent camp phosphodiestrerase inhibitor antidepressant PFIZER (US) 1994-03-02 EP disclosed
US-5196426-A CALCIUM INDEPENDENT C AMP PHOSPHODIESTERASE INHIBITOR ANTIDEPRESSANT PFIZER INC. (US) 1993-03-23 US disclosed
US-5128358-A Aryl substituted nitrogen heterocyclic antidepressants PFIZER INC. (US) 1992-07-07 US disclosed
EP-0247725-A2 Calcium independent camp phosphodiestrerase inhibitor antidepressant PFIZER INC. (US) 1987-12-02 EP disclosed
WO-1987006576-A1 CALCIUM INDEPENDENT CAMP PHOSPHODIESTERASE INHIBITOR ANTIDEPRESSANT PFIZER INC. (US) 1987-11-05 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 (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 ALDH1A1 2933/4885TSHR 2286/4885PDE4A 8/4885
US-20020002188-A1 Novel immunotherapeutic agents STING1, RNASE1, CGAS ALDH1A1 3254/4885TSHR 2595/4885PDE4A 7/4885
US-20030114516-A1 Novel immunotherapeutic agents STING1, RNASE1, CGAS ALDH1A1 3254/4885TSHR 2595/4885PDE4A 7/4885
US-20060003979-A1 Topical compositions of cyclic amides as immunotherapeutic agents TSLP, STING1, CGAS ALDH1A1 3455/4885TSHR 3945/4885PDE4A 8/4885
US-20060264477-A1 Methods of using cyclic amides RNASE1, RNGTT, CGAS ALDH1A1 3605/4885TSHR 2122/4885PDE4A 5/4885

“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.