SCHEMBL6908965

SCHEMBL6908965

CC(C)(C)OC(=O)NCc1ccc(CNC(=O)c2cc(F)cnc2Oc2ccc(F)cc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 7/20 0.71
PTGER2 P43116 2/20 0.60
L3MBTL1 Q9Y468 1/20 0.47
LIPG Q9Y5X9 1/20 0.46
NAMPT P43490 1/20 0.45
MAPT P10636 1/20 0.44
THRB P10828 1/20 0.44
GRM2 Q14416 1/20 0.44
CYP3A4 P08684 1/20 0.43
MAPK14 Q16539 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
SCHEMBL6906234 0.86 MAPK8 (0.61) PTGER4
SCHEMBL7181929 0.85 PTGER4 (0.84) PTGER4PTGER2L3MBTL1LIPGMAPT
SCHEMBL4450413 0.84 PTGER4 (0.81) PTGER4PTGER2LIPGMAPTTHRB
SCHEMBL4085505 0.83 PTGER4 (0.77) PTGER4PTGER2LIPGMAPTTHRB
Hydrochloric Acid SCHEMBL6908368 0.83 PTGER4 (0.77) PTGER4PTGER2L3MBTL1LIPGMAPT
SCHEMBL4450937 0.83 PTGER4 (1.00) PTGER4PTGER2CYP3A4MAPK14
SCHEMBL8350630 0.83 L3MBTL1 (0.52) PTGER4PTGER2L3MBTL1NAMPTMAPT
SCHEMBL13954366 0.82 PTGER4 (0.76) PTGER4PTGER2L3MBTL1LIPGMAPT
SCHEMBL4087663 0.82 PTGER4 (0.74) PTGER4PTGER2L3MBTL1LIPGMAPT
SCHEMBL4092310 0.82 PTGER4 (0.81) PTGER4PTGER2L3MBTL1LIPGCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1476157-A1 NICOTINAMIDE DERIVATIVES USEFUL AS PDE4 INHIBITORS Pfizer Limited (GB) 2004-11-17 EP disclosed
US-6756392-B2 CARBOCYCLIC SECONDARY AMIDES SUCH AS 2-(4-FLUORO-PHENOXY) -N-(4-((2-HYDROXY-3-METHYL-BENZOYL AMINO)-METHYL)-BENZYL)-NICOTINAMIDE, ADMINISTERED FOR PROPHYLAXIS OF RESPIRATORY SYSTEM DISORDERS PFIZER INC 2004-06-29 US disclosed
US-20030195233-A1 Nicotinamide derivatives useful as PDE4 inhibitors MAGEE THOMAS V (US) 2003-10-16 US disclosed
US-20030191158-A1 Antiinflamamtory agents; antiallergens PFIZER INC. 2003-10-09 US disclosed
WO-2003068232-A1 NICOTINAMIDE DERIVATIVES USEFUL AS PDE4 INHIBITORS PFIZER LIMITED (GB) 2003-08-21 WO disclosed
WO-2003068232-A1 NICOTINAMIDE DERIVATIVES USEFUL AS PDE4 INHIBITORS PFIZER LIMITED (GB) 2003-08-21 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 (2 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-20030195233-A1 Nicotinamide derivatives useful as PDE4 inhibitors PDE4A, PDE4B, PDE4C PTGER4 49/4885PTGER2 710/4885L3MBTL1 4491/4885
US-20030191158-A1 Antiinflamamtory agents; antiallergens NNMT, IL5, HNMT PTGER4 290/4885PTGER2 775/4885L3MBTL1 4376/4885

“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.