SCHEMBL7946466

SCHEMBL7946466

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

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.47
TOP2A P11388 3/20 0.43
TOP2B Q02880 3/20 0.43
KCNH2 Q12809 3/20 0.42
PDE4A P27815 1/20 0.42
PIK3CG P48736 1/20 0.42
GSK3B P49841 5/20 0.42
DPP4 P27487 3/20 0.42
PKM P14618 1/20 0.40
HTR3A P46098 1/20 0.40
ELANE P08246 1/20 0.40

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
SCHEMBL7951798 1.00 KDM4E (0.47) KDM4ETOP2ATOP2BKCNH2PDE4A
SCHEMBL7960307 0.91 KDM4E (0.55) KDM4ETOP2ATOP2BKCNH2PDE4A
SCHEMBL7963083 0.89 KDM4E (0.46) KDM4ETOP2ATOP2BKCNH2PDE4A
SCHEMBL7963082 0.89 KDM4E (0.46) KDM4ETOP2ATOP2BKCNH2PDE4A
SCHEMBL7966256 0.87 ELANE (0.53) PKMHTR3AELANE
SCHEMBL7966257 0.87 ELANE (0.53) PKMHTR3AELANE
SCHEMBL7963122 0.86 KDM4E (0.51) KDM4ETOP2ATOP2BKCNH2PDE4A
SCHEMBL7963124 0.86 KDM4E (0.51) KDM4ETOP2ATOP2BKCNH2PDE4A
SCHEMBL7946345 0.86 KDM4E (0.63) KDM4ETOP2ATOP2BKCNH2PDE4A
SCHEMBL7951788 0.86 KDM4E (0.60) KDM4ETOP2ATOP2BKCNH2PDE4A

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