SCHEMBL4065094

SCHEMBL4065094

COc1ccccc1N1C[CH]CCC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.56
DRD3 P35462 3/20 0.56
CYP2C19 P33261 2/20 0.54
HTR3E A5X5Y0 1/20 0.54
HTR3B O95264 1/20 0.54
ADRB1 P08588 1/20 0.54
HTR3A P46098 1/20 0.54
HTR6 P50406 1/20 0.54
HTR3D Q70Z44 1/20 0.54
HTR3C Q8WXA8 1/20 0.54
SIGMAR1 Q99720 1/20 0.54
MAPT P10636 4/20 0.53
LMNA P02545 2/20 0.53
ALDH1A1 P00352 5/20 0.51
HPGD P15428 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.50
USP2 O75604 1/20 0.50
KDM4E B2RXH2 1/20 0.46
POLB P06746 1/20 0.46
GAA P10253 2/20 0.46

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
SCHEMBL4071575 0.90 DRD2 (0.59) DRD2DRD3CYP2C19HTR3EHTR3B
SCHEMBL29138522 0.82 DRD2 (0.67) DRD2DRD3CYP2C19HTR3EHTR3B
SCHEMBL3165674 0.82 DRD2 (0.72) DRD2DRD3CYP2C19HTR3EHTR3B
SCHEMBL30407688 0.82 DRD2 (0.72) DRD2DRD3CYP2C19HTR3EHTR3B
Hydrochloric Acid SCHEMBL26690632 0.80 MAPT (0.71) DRD2DRD3CYP2C19HTR3EHTR3B
SCHEMBL3174809 0.80 DRD2 (0.70) DRD2DRD3CYP2C19HTR3EHTR3B
SCHEMBL3020451 0.80 DRD2 (0.70) DRD2DRD3CYP2C19HTR3EHTR3B
SCHEMBL4070096 0.80 L3MBTL1 (0.35) DRD2DRD3CYP2C19HTR3EHTR3B
SCHEMBL1267564 0.79 DRD2 (0.68) DRD2DRD3CYP2C19HTR3EHTR3B
SCHEMBL29124645 0.78 LMNA (0.41) DRD2DRD3CYP2C19HTR3EHTR3B

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 7 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-1415986-B1 SPIRO ISOBENZOFURANES AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS BANYU PHARMA CO LTD (JP) 2009-04-08 EP disclosed
EP-1991540-A1 CINNOLINE DERIVATIVES AS PHOSPHODIESTERASE 10 INHIBITORS Amgen Inc. (US) 2008-11-19 EP disclosed
US-20070265270-A1 Cinnoline derivatives as phosphodiesterase 10 inhibitors MEMORY PHARMACEUTICALS CORPORATION 2007-11-15 US disclosed
WO-2007098214-A1 CINNOLINE DERIVATIVES AS PHOSPHODIESTERASE 10 INHIBITORS AMGEN INC. (US) 2007-08-30 WO disclosed
US-7205417-B2 Spiro compounds BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-04-17 US disclosed
CN-1538956-A Spiro compounds ������ҩ��ʽ���� 2004-10-20 CN 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-20070265270-A1 Cinnoline derivatives as phosphodiesterase 10 inhibitors PDE7A, PDE10A, PDE7B DRD2 314/4885DRD3 251/4885CYP2C19 439/4885

“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.