SCHEMBL4776351

SCHEMBL4776351

COCCOc1cc2c(-n3ncc4c(N5CCCC5)cccc43)cnnc2cc1OC

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EHMT2 Q96KQ7 5/20 0.47
EHMT1 Q9H9B1 5/20 0.47
PDPK1 O15530 2/20 0.44
KDR P35968 4/20 0.41
FLT1 P17948 2/20 0.41
FGFR1 P11362 1/20 0.41
NCF1 P14598 1/20 0.39
KMT5A Q9NQR1 2/20 0.39
PDE10A Q9Y233 2/20 0.39
PDGFRB P09619 1/20 0.39
SCN9A Q15858 1/20 0.38
KDM1A O60341 1/20 0.38
SLC2A1 P11166 1/20 0.36
SLC2A2 P11168 1/20 0.36
SLC2A3 P11169 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
SCHEMBL4793421 0.93 NCF1 (0.49) EHMT2EHMT1PDPK1KDRFLT1
SCHEMBL4979935 0.92 PDE10A (0.45) EHMT2EHMT1NCF1PDE10APDGFRB
SCHEMBL4792601 0.89 HTR1A (0.43) EHMT2EHMT1KDRFLT1FGFR1
SCHEMBL5479282 0.88 FLT1 (0.46) PDPK1KDRFLT1FGFR1PDE10A
SCHEMBL4975789 0.87 FLT1 (0.44) PDPK1KDRFLT1FGFR1PDE10A
SCHEMBL4779758 0.85 KDR (0.44) PDPK1KDRFLT1FGFR1PDE10A
SCHEMBL5653805 0.84 PDGFRB (0.44) EHMT2NCF1PDE10APDGFRBSLC2A1
SCHEMBL4981518 0.84 NCF1 (0.55) NCF1PDE10APDGFRBSLC2A1SLC2A2
SCHEMBL4984909 0.83 PDE10A (0.50) EHMT2EHMT1NCF1PDE10APDGFRB
SCHEMBL5655080 0.80 HTR1A (0.46) EHMT2PDE10APDGFRBSCN9ASLC2A1

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-1991531-A1 CINNOLINE AND QUINOXALINE DERIVATES AS PHOSPHODIESTERASE 10 INHIBITORS Amgen Inc. (US) 2008-11-19 EP disclosed
US-20070287707-A1 Phosphodiesterase 10 inhibitors MEMORY PHARMACEUTICALS CORPORATION 2007-12-13 US disclosed
US-20070287707-A1 Phosphodiesterase 10 inhibitors MEMORY PHARMACEUTICALS CORPORATION 2007-12-13 US disclosed
US-20070287707-A1 Phosphodiesterase 10 inhibitors MEMORY PHARMACEUTICALS CORPORATION 2007-12-13 US disclosed
WO-2007100880-A1 CINNOLINE AND QUINAZOLINE DERIVATES AS PHOSPHODIESTERASE 10 INHIBITORS AMGEN INC. (US) 2007-09-07 WO disclosed
WO-2007100880-A1 CINNOLINE AND QUINAZOLINE DERIVATES AS PHOSPHODIESTERASE 10 INHIBITORS AMGEN INC. (US) 2007-09-07 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-20070287707-A1 Phosphodiesterase 10 inhibitors PDE7A, PDE7B, PDE10A EHMT2 3772/4885EHMT1 3121/4885PDPK1 180/4885

“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.