SCHEMBL7960320

SCHEMBL7960320

O=C(Nc1ccncc1Cl)c1cn([C@H]2CC[C@H](O)CC2)c2ncccc2c1=O

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 5/20 0.49
PDE4A P27815 3/20 0.49
PDE4B Q07343 1/20 0.46
PDE4C Q08493 1/20 0.46
PDE4D Q08499 1/20 0.46
PKM P14618 2/20 0.42
IRAK4 Q9NWZ3 3/20 0.39
SYK P43405 2/20 0.39
TYK2 P29597 1/20 0.38
ELANE P08246 1/20 0.38
ATR Q13535 1/20 0.38
PABPC1 P11940 1/20 0.37
EIF4H Q15056 1/20 0.37
IKBKE Q14164 1/20 0.37
TBK1 Q9UHD2 1/20 0.37
BCL6 P41182 1/20 0.37

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
SCHEMBL7966583 1.00 KCNH2 (0.49) KCNH2PDE4APDE4BPDE4CPDE4D
SCHEMBL7960214 0.91 KCNH2 (0.49) KCNH2PDE4APDE4BPDE4CPDE4D
SCHEMBL7966470 0.89 PKM (0.42) KCNH2PDE4APDE4BPDE4CPDE4D
SCHEMBL7966474 0.89 PKM (0.42) KCNH2PDE4APDE4BPDE4CPDE4D
SCHEMBL7954732 0.89 PDE4A (0.62) KCNH2PDE4APDE4BPDE4CPDE4D
SCHEMBL7960372 0.89 PDE4A (0.62) KCNH2PDE4APDE4BPDE4CPDE4D
SCHEMBL7963094 0.89 PDE4A (0.62) KCNH2PDE4APDE4BPDE4CPDE4D
SCHEMBL7962912 0.85 HTT (0.47) KCNH2PDE4APKMELANE
SCHEMBL7962911 0.85 HTT (0.47) KCNH2PDE4APKMELANE
SCHEMBL7966418 0.85 PKM (0.44) KCNH2PDE4APDE4BPDE4CPDE4D

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
US-6331548-B1 PREVENTION OR TREATMENT OF CYTOKINE RELATED DISEASES SUNTORY LIMITED (JP) 2001-12-18 US disclosed
EP-0978516-A1 1-CYCLOALKYL-1,8-NAPHTHYRIDIN-4-ONE DERIVATIVES WITH PHOSPHODIESTERASE IV INHIBITORY ACTIVITY SUNTORY LIMITED (JP) 2000-02-09 EP disclosed