SCHEMBL8320226

SCHEMBL8320226

COC(C)(c1ccc(C)cc1)c1c[nH]c2c(N)cccc12

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
IMPDH2 P12268 1/20 0.36
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
BLM P54132 1/20 0.33
KMT2A Q03164 1/20 0.33
MCL1 Q07820 1/20 0.33
TSHR P16473 1/20 0.33
CLK1 P49759 1/20 0.32
CDK5 Q00535 1/20 0.32
CDK5R1 Q15078 1/20 0.32
PARP1 P09874 1/20 0.32
NR3C1 P04150 3/20 0.31
PGR P06401 3/20 0.31
NR3C2 P08235 3/20 0.31
AR P10275 3/20 0.31
NR4A2 P43354 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
SCHEMBL6090728 0.83 IMPDH2 (0.39) IMPDH2KDM4EMEN1LMNAPOLB
SCHEMBL6092231 0.69 KIF11 (0.34) IMPDH2KDM4EMEN1LMNAPOLB
SCHEMBL27174846 0.69 IMPDH2 (0.46) IMPDH2KDM4EMEN1LMNAPOLB
SCHEMBL9504874 0.67 TSHR (0.62) LMNAMAPTTSHR
SCHEMBL15591975 0.66 KIF11 (0.52) KDM4ETSHRNR3C1PGRNR3C2
SCHEMBL7089054 0.66 REN (0.50) IMPDH2KDM4EPOLBMAPTTSHR
SCHEMBL8331367 0.66 NR3C1 (0.66) IMPDH2CLK1CDK5CDK5R1NR3C1
SCHEMBL6089244 0.66 NR3C1 (0.39) IMPDH2KDM4EMEN1LMNAPOLB
SCHEMBL28995681 0.66 KDM4E (0.53) IMPDH2KDM4EMEN1LMNAPOLB
SCHEMBL6091711 0.65 KIF11 (0.39) IMPDH2KDM4EMEN1LMNAPOLB

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-2004067529-A1 INDOLE-DERIVATIVE MODULATORS OF STEROID HORMONE NUCLEAR RECEPTORS ELI LILLY AND COMPANY (US) 2004-08-12 WO disclosed