SCHEMBL4974699

SCHEMBL4974699

O=C1CCCCN1C1CCC[N]C1

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 2/20 0.34
▸ DPP8 Q6V1X1 1/20 0.34
▸ DPP9 Q86TI2 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ HRH1 P35367 1/20 0.34
▸ NPY5R Q15761 2/20 0.33
▸ JAK2 O60674 1/20 0.33
▸ JAK1 P23458 1/20 0.33
▸ JAK3 P52333 1/20 0.33
▸ VNN1 O95497 1/20 0.33
▸ LTA4H P09960 3/20 0.32
▸ HRH3 Q9Y5N1 1/20 0.32
▸ CTSS P25774 1/20 0.32
▸ NOS1 P29475 2/20 0.32
▸ NOS3 P29474 1/20 0.32
▸ KDM5A P29375 1/20 0.31
▸ KCNH2 Q12809 2/20 0.31

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
SCHEMBL4972996 1.00 DPP4 (0.34) DPP4DPP8DPP9CYP2D6HRH1
SCHEMBL4971277 1.00 DPP4 (0.34) DPP4DPP8DPP9CYP2D6HRH1
SCHEMBL4973633 0.95 JAK2 (0.36) DPP4DPP8DPP9NPY5RJAK2
SCHEMBL4973627 0.95 JAK2 (0.36) DPP4DPP8DPP9NPY5RJAK2
SCHEMBL4480479 0.86 KDM5A (0.34) DPP4DPP8DPP9CYP2D6HRH1
SCHEMBL4461347 0.82 DPP4 (0.40) DPP4DPP8DPP9CYP2D6HRH1
SCHEMBL6103837 0.79 NOS3 (0.43) DPP4DPP8DPP9CYP2D6HRH1
SCHEMBL19271810 0.79 NOS3 (0.43) DPP4DPP8DPP9CYP2D6HRH1
SCHEMBL337152 0.78 AKR1C3 (0.32) —
SCHEMBL6088399 0.77 NOS3 (0.42) DPP4DPP8DPP9CYP2D6HRH1

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
US-20070265270-A1 Cinnoline derivatives as phosphodiesterase 10 inhibitors MEMORY PHARMACEUTICALS CORPORATION 2007-11-15 — — US claimed
EP-1991540-A1 CINNOLINE DERIVATIVES AS PHOSPHODIESTERASE 10 INHIBITORS Amgen Inc. (US) 2008-11-19 — — EP disclosed
US-20070299067-A1 Quinoline and isoquinoline derivatives as phosphodiesterase 10 inhibitors AMGEN INC. 2007-12-27 — — US disclosed
US-20070265270-A1 Cinnoline derivatives as phosphodiesterase 10 inhibitors MEMORY PHARMACEUTICALS CORPORATION 2007-11-15 — — US disclosed
US-20070265258-A1 Quinazoline derivatives as phosphodiesterase 10 inhibitors AMGEN INC. 2007-11-15 — — US disclosed
WO-2007098214-A1 CINNOLINE DERIVATIVES AS PHOSPHODIESTERASE 10 INHIBITORS AMGEN INC. (US) 2007-08-30 — — 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 (3 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-20070265270-A1 Cinnoline derivatives as phosphodiesterase 10 inhibitors PDE7A, PDE10A, PDE7B DPP4 171/4885DPP8 200/4885DPP9 78/4885
US-20070299067-A1 Quinoline and isoquinoline derivatives as phosphodiesterase 10 inhibitors PDE12, PDE10A, PDE4A DPP4 69/4885DPP8 322/4885DPP9 140/4885
US-20070265258-A1 Quinazoline derivatives as phosphodiesterase 10 inhibitors PDE12, PDE5A, PDE7A DPP4 32/4885DPP8 74/4885DPP9 31/4885

“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.

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