SCHEMBL2907869

SCHEMBL2907869

COc1ccc(C(Nc2ccc(C(=O)NS(=O)(=O)c3ccc(F)cc3)cc2)c2cccnc2)cc1F

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 4/20 0.51
PTGS1 P23219 1/20 0.44
NAMPT P43490 4/20 0.44
KMT2A Q03164 5/20 0.43
ALDH1A1 P00352 4/20 0.43
KDM4E B2RXH2 3/20 0.43
LMNA P02545 3/20 0.43
MAPT P10636 3/20 0.43
MEN1 O00255 3/20 0.43
HPGD P15428 1/20 0.43
EGFR P00533 2/20 0.42
POLB P06746 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
ALPL P05186 1/20 0.41

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
SCHEMBL2905934 0.84 RCE1 (0.50) NAMPTALDH1A1LMNAPOLB
SCHEMBL2909821 0.76 LMNA (0.45) ALDH1A1KDM4ELMNAMAPTPOLB
SCHEMBL2908503 0.73 RCE1 (0.50) NAMPTKMT2AALDH1A1LMNAMAPT
SCHEMBL2909129 0.72 KMT2A (0.45) NAMPTKMT2AALDH1A1KDM4ELMNA
SCHEMBL6469174 0.71 PTGS2 (0.52) PTGS2PTGS1NAMPTKMT2ALMNA
SCHEMBL6527184 0.69 PTGS2 (0.42) PTGS2ALDH1A1LMNAMAPTPOLB
SCHEMBL3202700 0.68 LMNA (0.40) NAMPTKMT2AALDH1A1KDM4ELMNA
SCHEMBL6468561 0.68 GAA (0.40) PTGS2NAMPTKMT2AALDH1A1KDM4E
SCHEMBL4202489 0.68 GAA (0.49) PTGS2NAMPTKMT2AALDH1A1MEN1
SCHEMBL2903512 0.66 MRGPRX4 (0.41) KMT2AALDH1A1KDM4ELMNAMAPT

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
JP-2007513957-A 2007-05-31 JP claimed
EP-1692109-A2 PHOSPHODIESTERASE 4 INHIBITORS, INCLUDING N-SUBSTITUTED DIARYLAMINE ANALOGS Memory Pharmaceuticals Corporation (US) 2006-08-23 EP claimed
US-20050222207-A1 Phosphodiesterase 4 inhibitors, including N-substituted diarylamine analogs MEMORY PHARMACEUTICAL CORPORATION 2005-10-06 US claimed
WO-2005061458-A2 PHOSPHODIESTERASE 4 INHIBITORS, INCLUDING N-SUBSTITUTED DIARYLAMINE ANALOGS MEMORY PHARMACEUTICALS CORPORATION (US) 2005-07-07 WO claimed
EP-1692109-B1 PHOSPHODIESTERASE 4 INHIBITORS, INCLUDING N-SUBSTITUTED DIARYLAMINE ANALOGS MEMORY PHARM CORP (US) 2010-08-18 EP disclosed
EP-1692109-A2 PHOSPHODIESTERASE 4 INHIBITORS, INCLUDING N-SUBSTITUTED DIARYLAMINE ANALOGS Memory Pharmaceuticals Corporation (US) 2006-08-23 EP disclosed
US-20050222207-A1 Phosphodiesterase 4 inhibitors, including N-substituted diarylamine analogs MEMORY PHARMACEUTICAL CORPORATION 2005-10-06 US disclosed
WO-2005061458-A2 PHOSPHODIESTERASE 4 INHIBITORS, INCLUDING N-SUBSTITUTED DIARYLAMINE ANALOGS MEMORY PHARMACEUTICALS CORPORATION (US) 2005-07-07 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 (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-20050222207-A1 Phosphodiesterase 4 inhibitors, including N-substituted diarylamine analogs PDE4A, PDE4B, PDE3B PTGS2 569/4885PTGS1 218/4885NAMPT 953/4885

“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.