SCHEMBL12112930

SCHEMBL12112930

Fc1cccc2nc(Nc3ccc(Oc4nccnc4Cl)cc3)[nH]c12

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 9/20 0.45
CSNK1A1 P48729 2/20 0.41
CSNK1D P48730 2/20 0.41
GSK3B P49841 1/20 0.41
CSNK1G2 P78368 1/20 0.41
TEK Q02763 1/20 0.41
KDR P35968 3/20 0.41
KDM4E B2RXH2 1/20 0.36
RAF1 P04049 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
SCHEMBL1304114 0.82 PDE10A (0.65) PDE10ACSNK1A1CSNK1DGSK3BCSNK1G2
SCHEMBL1302496 0.78 PDE10A (0.50) PDE10A
SCHEMBL1304364 0.77 PDE10A (0.53) PDE10A
SCHEMBL2494438 0.74 PDE10A (0.67) PDE10ACSNK1A1CSNK1DGSK3BCSNK1G2
SCHEMBL2482809 0.74 P2RX3 (0.43)
SCHEMBL2490704 0.72 PDE10A (0.49) PDE10ACSNK1A1CSNK1DGSK3BCSNK1G2
SCHEMBL2488508 0.71 PDE10A (0.64) PDE10ACSNK1A1CSNK1DGSK3BCSNK1G2
SCHEMBL3321188 0.70 PDE10A (0.62) PDE10ACSNK1A1CSNK1DGSK3BCSNK1G2
SCHEMBL5695252 0.69 ADRA2A (0.44) KDRKDM4E
Hydrochloric Acid SCHEMBL6497666 0.68 ADRA2A (0.43) KDRKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8053438-B2 Pyrazine compounds as phosphodiesterase 10 inhibitors AMGEN INC. (US) 2011-11-08 US disclosed
US-8053438-B2 Pyrazine compounds as phosphodiesterase 10 inhibitors AMGEN INC. (US) 2011-11-08 US disclosed
US-20100137278-A1 PYRAZINE COMPOUNDS AS PHOSPHODIESTERASE 10 INHIBITORS AMGEN INC. (US) 2010-06-03 US disclosed
US-20100137278-A1 PYRAZINE COMPOUNDS AS PHOSPHODIESTERASE 10 INHIBITORS AMGEN INC. (US) 2010-06-03 US 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-20100137278-A1 PYRAZINE COMPOUNDS AS PHOSPHODIESTERASE 10 INHIBITORS PDE10A, PDE12, PDE5A PDE10A 1/4885CSNK1A1 3388/4885CSNK1D 3398/4885

“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.