SCHEMBL4190693

SCHEMBL4190693

Cc1n[nH]c2c1C(=O)[N]C=N2

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 1/20 0.32
AKT2 P31751 1/20 0.32
CYP1A2 P05177 1/20 0.31
PDPK1 O15530 1/20 0.30

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
SCHEMBL336074 0.58
SCHEMBL17561029 0.56 AKT2 (0.58) CHEK1AKT2
SCHEMBL14826495 0.56 ADORA2A (0.42) CYP1A2PDPK1
SCHEMBL12657752 0.55
SCHEMBL25332682 0.55 PDPK1 (0.34) CYP1A2PDPK1
SCHEMBL170835 0.53 GDA (0.35)
SCHEMBL19154248 0.53 PDPK1 (0.40) CYP1A2PDPK1
SCHEMBL24000490 0.53 GRIN2D (0.43) CYP1A2PDPK1
SCHEMBL24131106 0.53
SCHEMBL16209719 0.53 AKT2 (0.79) CHEK1AKT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2024360-A2 SUBSTITUTED PYRAZOLOPYRIMIDINES Cephalon, Inc. (US) 2009-02-18 EP disclosed
WO-2008063232-A2 SUBSTITUTED PYRAZOLOPYRIMIDINES CEPHALON, INC. (US) 2008-05-29 WO disclosed