SCHEMBL7946356

SCHEMBL7946356

CC(C)(C)[Si](O[C@H]1CC[C@H](n2cc(C(=O)O)c(=O)c3cccnc32)CC1)(c1ccccc1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.43
PDE4A P27815 1/20 0.39
KCNH2 Q12809 1/20 0.39
GSK3B P49841 5/20 0.38
TOP2A P11388 3/20 0.38
TOP2B Q02880 3/20 0.38
DPP4 P27487 3/20 0.38
PIK3CG P48736 1/20 0.37
HTR6 P50406 2/20 0.37
HTR3A P46098 2/20 0.36
PKM P14618 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
SCHEMBL7960397 1.00 KDM4E (0.43) KDM4EPDE4AKCNH2GSK3BTOP2A
SCHEMBL7960402 0.90 PDE4A (0.43) PDE4AKCNH2HTR6PKM
SCHEMBL7966136 0.90 ELANE (0.46) PDE4AKCNH2HTR6HTR3A
SCHEMBL7955415 0.90 PDE4A (0.43) PDE4AKCNH2HTR6PKM
SCHEMBL7966137 0.90 ELANE (0.46) PDE4AKCNH2HTR6HTR3A
SCHEMBL7963505 0.90 PDE4A (0.46) PDE4AKCNH2
SCHEMBL7960314 0.90 PDE4A (0.46) PDE4AKCNH2
SCHEMBL7966424 0.88 PDE4A (0.43) PDE4AKCNH2
SCHEMBL7951809 0.88 PDE4A (0.43) PDE4AKCNH2
SCHEMBL7951811 0.88 PDE4A (0.43) PDE4AKCNH2

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