SCHEMBL14765204

SCHEMBL14765204

Cc1nc2cc(F)ccc2n2c(-c3ccccc3Cl)nnc12

nearest known ligand 0.82

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 20/20 0.82
PDE10A Q9Y233 15/20 0.82
PDE4D Q08499 1/20 0.62
PDE11A Q9HCR9 1/20 0.62

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
SCHEMBL12503036 0.90 PDE2A (1.00) PDE2APDE10APDE4DPDE11A
SCHEMBL14764901 0.88 PDE2A (0.78) PDE2APDE10APDE4DPDE11A
SCHEMBL14764974 0.88 PDE2A (0.81) PDE2APDE10APDE4DPDE11A
SCHEMBL12502542 0.85 PDE2A (1.00) PDE2APDE10APDE4DPDE11A
SCHEMBL14359712 0.85 PDE2A (0.82) PDE2APDE10APDE4DPDE11A
SCHEMBL12502893 0.84 PDE2A (1.00) PDE2APDE10APDE4DPDE11A
SCHEMBL12502539 0.84 PDE2A (0.77) PDE2APDE10A
SCHEMBL14764848 0.83 PDE2A (0.71) PDE2APDE10APDE4DPDE11A
SCHEMBL12502553 0.83 PDE2A (1.00) PDE2APDE10APDE4D
SCHEMBL3330230 0.83 PDE2A (0.82) PDE2APDE10APDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014139983-A1 [1,2,4]TRIAZOLO[4,3-A]QUINOXALINES AS DUAL PDE2/PDE10 INHIBITORS H. LUNDBECK A/S (DK) 2014-09-18 WO disclosed
WO-2013034755-A1 TRIAZOLOPYRAZINE DERIVATIVES AND THEIR USE FOR TREATING NEUROLOGICAL AND PSYCHIATRIC DISORDERS H. LUNDBECK A/S (DK) 2013-03-14 WO disclosed
WO-2013034755-A1 TRIAZOLOPYRAZINE DERIVATIVES AND THEIR USE FOR TREATING NEUROLOGICAL AND PSYCHIATRIC DISORDERS H. LUNDBECK A/S (DK) 2013-03-14 WO disclosed