SCHEMBL3657322

SCHEMBL3657322

CCc1nc(C)c2c(NS(C)(=O)=O)nc3ccc(N4CCCCC4)cc3n12

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 9/20 0.54
PDE2A O00408 1/20 0.46
PDE5A O76074 1/20 0.46
PDE3A Q14432 1/20 0.46
PDE11A Q9HCR9 1/20 0.46
MET P08581 1/20 0.38
PSMB1 P20618 1/20 0.37
PSMB5 P28074 1/20 0.37
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
SIRT2 Q8IXJ6 2/20 0.35
SIRT1 Q96EB6 2/20 0.35
PIK3CA P42336 1/20 0.35
ADORA3 P0DMS8 1/20 0.35

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
SCHEMBL971482 0.86 PSMB1 (0.45) PDE10APDE2APDE5APDE3APSMB1
SCHEMBL3795533 0.81 PDE10A (0.60) PDE10APDE2APDE5APDE3APDE11A
SCHEMBL971294 0.80 PSMB1 (0.39) PDE10APDE2APDE5APDE3APSMB1
SCHEMBL970787 0.80 MAP4K4 (0.43) PDE10APDE2APDE5APDE3APSMB1
SCHEMBL3661029 0.79 PDE10A (0.61) PDE10APDE2APDE5APDE3APDE11A
SCHEMBL3658183 0.77 PDE10A (0.55) PDE10APDE2APDE5APDE3APDE11A
SCHEMBL3662037 0.73 PDE10A (0.61) PDE10APDE2APDE5APDE3APDE11A
SCHEMBL971019 0.72 PDE3B (0.61) PDE10APDE2APDE5APDE3ASMN1; SMN2
SCHEMBL7268354 0.71 PDE3B (0.62) PDE10APDE2APDE5APDE3ASMN1; SMN2
SCHEMBL3660134 0.69 PDE10A (0.55) PDE10APDE2APDE5APDE3APDE11A

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-2227472-A1 ARYL AND HETEROARYL FUSED IMIDAZO (1,5-A) PYRAZINES AS INHIBITORS OF PHOSPHODIESTERASE 10 Elbion Gmbh (DE) 2010-09-15 EP claimed
WO-2009068320-A1 ARYL AND HETEROARYL FUSED IMIDAZO (1,5-A) PYRAZINES AS INHIBITORS OF PHOSPHODIESTERASE 10 ELBION GMBH (DE) 2009-06-04 WO claimed
US-20090143391-A1 Aryl and heteroaryl fused imidazo [1,5-a] pyrazines as inhibitors of phosphodiesterase 10 ELBION GMBH (DE) 2009-06-04 US claimed
EP-2227472-A1 ARYL AND HETEROARYL FUSED IMIDAZO (1,5-A) PYRAZINES AS INHIBITORS OF PHOSPHODIESTERASE 10 Elbion Gmbh (DE) 2010-09-15 EP disclosed
WO-2009068320-A1 ARYL AND HETEROARYL FUSED IMIDAZO (1,5-A) PYRAZINES AS INHIBITORS OF PHOSPHODIESTERASE 10 ELBION GMBH (DE) 2009-06-04 WO disclosed
US-20090143391-A1 Aryl and heteroaryl fused imidazo [1,5-a] pyrazines as inhibitors of phosphodiesterase 10 ELBION GMBH (DE) 2009-06-04 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-20090143391-A1 Aryl and heteroaryl fused imidazo [1,5-a] pyrazines as inhibitors of phosphodiesterase 10 PDE12, PDE5A, PDE10A PDE10A 3/4885PDE2A 6/4885PDE5A 2/4885

“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.