SCHEMBL11244705

SCHEMBL11244705

CC1(C)CC1C(=O)OCc1cccc(Oc2ccccc2)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.38
LMNA P02545 1/20 0.38
ADRA2A P08913 1/20 0.38
CNR1 P21554 1/20 0.38
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
KCNH2 Q12809 1/20 0.36
ADAM17 P78536 3/20 0.35
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 1/20 0.35
HSD17B14 Q9BPX1 1/20 0.34
OPRM1 P35372 1/20 0.34
RAB9A P51151 2/20 0.34
MAPT P10636 1/20 0.34
APP P05067 1/20 0.34
PPARG P37231 1/20 0.34
NPC1 O15118 1/20 0.33
EZH2 Q15910 1/20 0.33
GAA P10253 1/20 0.33
FKBP1A P62942 1/20 0.33

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
SCHEMBL11351076 0.85 TDP1 (0.39) TDP1LMNAADRA2ACNR1ATM
SCHEMBL11275809 0.79 ALDH1A1 (0.47) L3MBTL1KCNH2KDM4EALDH1A1HSD17B14
SCHEMBL9789537 0.79 TDP1 (0.35) TDP1LMNAADRA2ACNR1ATM
SCHEMBL11245639 0.78 TDP1 (0.66) TDP1LMNAADRA2ACNR1ATM
SCHEMBL10933144 0.78 TDP1 (0.66) TDP1LMNAADRA2ACNR1ATM
SCHEMBL11245643 0.78 TDP1 (0.66) TDP1LMNAADRA2ACNR1ATM
SCHEMBL13062898 0.77 TDP1 (0.61) TDP1LMNAADRA2ACNR1ATM
SCHEMBL11456425 0.76 TDP1 (0.39) TDP1LMNAADRA2ACNR1ATM
SCHEMBL10706094 0.74 TDP1 (0.53) TDP1LMNAADRA2ACNR1ATM
SCHEMBL10706088 0.74 TDP1 (0.53) TDP1LMNAADRA2ACNR1ATM

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
US-4323574-A INSECTICIDES, PESTICIDES ZOECON CORPORATION (US) 1982-04-06 US disclosed