SCHEMBL23283129

SCHEMBL23283129

O=C(O)c1c(Cl)cnn1[C@H]1CCOC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 4/20 0.42
PDE10A Q9Y233 1/20 0.37
BRD4 O60885 2/20 0.36
CREBBP Q92793 2/20 0.36
PDE1A P54750 3/20 0.36
PDE1B Q01064 3/20 0.36
PDE1C Q14123 3/20 0.36
PDE4D Q08499 1/20 0.36
KCNJ6 P48051 1/20 0.35
KCNJ5 P48544 1/20 0.35
KCNJ3 P48549 1/20 0.35
HSD11B1 P28845 1/20 0.35
NR3C1 P04150 1/20 0.35
POLB P06746 1/20 0.35
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
PIK3CD O00329 2/20 0.34
ABL1 P00519 2/20 0.34
EGFR P00533 2/20 0.34
HCK P08631 2/20 0.34

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
SCHEMBL27236771 0.76 PDE10A (0.40) KDM4CPDE10APDE1APDE1BPDE1C
SCHEMBL27236898 0.76 PDE10A (0.40) KDM4CPDE10APDE1APDE1BPDE1C
SCHEMBL25291888 0.76 MAP3K12 (0.37) KDM4CPDE10ABRD4CREBBPPDE1A
SCHEMBL23273712 0.74 HTT (0.44) NR3C1NPC1RAB9APIK3CDPIK3CA
SCHEMBL1406557 0.74 NR3C1 (0.43) KDM4CPDE1APDE1BPDE1CPDE4D
SCHEMBL25791523 0.72 CNR2 (0.43) KDM4CBRD4CREBBPPDE1APDE1B
SCHEMBL22366382 0.72 KDM4C (0.42) KDM4CHSD11B1POLBPIK3CDSRC
SCHEMBL21879889 0.71 TGFBR1 (0.36) KDM4CABL1
SCHEMBL21879893 0.71 TGFBR1 (0.36) KDM4CABL1
SCHEMBL23273717 0.71 PKM (0.37) HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021080015-A1 MODULATORS OF TREK (TWIK RELATED K+ CHANNELS) CHANNEL FUNCTION ONO PHARMACEUTICAL CO., LTD. (JP) 2021-04-29 WO disclosed