SCHEMBL4771930

SCHEMBL4771930

CNS(=O)(=O)c1ccc2c(c1)CCN2c1cnnc2cc(OC)c(OC)cc12

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.42
BRAF P15056 2/20 0.41
TNNI3K Q59H18 2/20 0.41
EGFR P00533 3/20 0.40
KDR P35968 1/20 0.40
PDGFRB P09619 1/20 0.40
THRB P10828 1/20 0.39
CSF1R P07333 1/20 0.39
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
PDE10A Q9Y233 2/20 0.38
KDM1A O60341 1/20 0.37
ADRB2 P07550 1/20 0.37
ADRB1 P08588 1/20 0.37
ADRB3 P13945 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
TP53 P04637 1/20 0.36

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
SCHEMBL5247389 0.90 ALDH1A1 (0.46) SMN1; SMN2LMNAPDE10AMEN1KMT2A
SCHEMBL4772001 0.90 THRB (0.45) SMN1; SMN2EGFRPDGFRBTHRBCSF1R
SCHEMBL4779000 0.90 ALDH1A1 (0.41) SMN1; SMN2PDGFRBTHRBLMNAMAPT
SCHEMBL8266920 0.89 SMN1; SMN2 (0.38) SMN1; SMN2PDGFRBTHRBLMNAMAPT
SCHEMBL4772378 0.89 ROCK1 (0.46) SMN1; SMN2EGFRPDGFRBCSF1RPDE10A
SCHEMBL4772005 0.88 ALDH1A1 (0.46) THRBLMNAADRB2ADRB1ADRB3
SCHEMBL4772434 0.87 ALDH1A1 (0.46) SMN1; SMN2THRBLMNAMAPTMEN1
SCHEMBL4796030 0.86 LMNA (0.43) SMN1; SMN2THRBLMNAMAPTPDE10A
SCHEMBL4775163 0.86 KMT2A (0.40) SMN1; SMN2EGFRKDRPDGFRBCSF1R
SCHEMBL4792968 0.85 ALDH1A1 (0.46) SMN1; SMN2LMNAMAPTTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1991530-A1 CINNOLINE DERIVATIVES AS PHOSPHODIESTERASE 10 INHIBITORS Amgen Inc. (US) 2008-11-19 EP claimed
US-20070265256-A1 Phosphodiesterase 10 inhibitors AMGEN INC. 2007-11-15 US claimed
WO-2007098169-A1 CINNOLINE DERIVATIVES AS PHOSPHODIESTERASE 10 INHIBITORS AMGEN INC. (US) 2007-08-30 WO claimed
US-20060160814-A1 Phosphodiesterase 10 inhibitors MEMORY PHARMACEUTICALS CORPORATION 2006-07-20 US claimed
EP-1991530-A1 CINNOLINE DERIVATIVES AS PHOSPHODIESTERASE 10 INHIBITORS Amgen Inc. (US) 2008-11-19 EP disclosed
US-20070265256-A1 Phosphodiesterase 10 inhibitors AMGEN INC. 2007-11-15 US disclosed
WO-2007098169-A1 CINNOLINE DERIVATIVES AS PHOSPHODIESTERASE 10 INHIBITORS AMGEN INC. (US) 2007-08-30 WO disclosed
EP-1802585-A1 4-SUBSTITUTED 4,6-DIALKOXY-CINNOLINE DERIVATIVES AS PHOSPODIESTERASE 10 INHIBITORS FOR THE TREATMENT OF PSYCHIATRIC OR NEUROLOGICAL SYNDROMS Memory Pharmaceuticals Corporation (US) 2007-07-04 EP disclosed
US-20060160814-A1 Phosphodiesterase 10 inhibitors MEMORY PHARMACEUTICALS CORPORATION 2006-07-20 US disclosed
WO-2006028957-A1 4-SUBSTITUTED 4, 6-DIALKOXY-CINNOLINE DERIVATIVES AS PHOSPODIESTERASE 10 INHIBITORS FOR THE TREATMENT OF PSYCHIATRIC OR NEUROLOGICAL SYNDROMS MEMORY PHARMACEUTICALS CORPORATION (US) 2006-03-16 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-20070265256-A1 Phosphodiesterase 10 inhibitors PDE7A, PDE7B, PDE10A SMN1; SMN2 4053/4885BRAF 3732/4885TNNI3K 3406/4885
US-20060160814-A1 Phosphodiesterase 10 inhibitors PDE5A, PDE3A, PDE2A SMN1; SMN2 2780/4885BRAF 3728/4885TNNI3K 2174/4885

“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.