SCHEMBL10569031

SCHEMBL10569031

Cc1oc(=O)oc1CN1CCN(c2c(F)cc3c(=O)c(C(=O)O)cn(C4CC4)c3c2C)CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 6/20 0.58
KDM4E B2RXH2 6/20 0.49
ALDH1A1 P00352 5/20 0.49
HPGD P15428 4/20 0.49
HSD17B10 Q99714 4/20 0.49
LMNA P02545 2/20 0.49
MAPT P10636 1/20 0.49
POLB P06746 3/20 0.48
OPRM1 P35372 2/20 0.48
CHRM2 P08172 1/20 0.48
CHRM1 P11229 1/20 0.48
OPRD1 P41143 1/20 0.48
PRKD3 O94806 1/20 0.47
ALOX15 P16050 1/20 0.47
CLK2 P49760 1/20 0.47
CLK4 Q9HAZ1 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
ALB P02768 1/20 0.46
HRH3 Q9Y5N1 1/20 0.46
TOP2A P11388 1/20 0.46

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
SCHEMBL10507569 0.94 TOP2A (0.51) KCNH2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL10508242 0.92 ALDH1A1 (0.59) KCNH2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL10507545 0.88 ALDH1A1 (0.46) KCNH2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL10569538 0.85 KCNH2 (0.69) KCNH2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL8557025 0.85 MEN1 (0.49) KCNH2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL10575167 0.84 KCNH2 (0.62) KCNH2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL10510579 0.84 KDM4E (0.71) KDM4EALDH1A1HPGDHSD17B10LMNA
SCHEMBL10507575 0.84 LMNA (0.45) KCNH2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL10508029 0.84 ALDH1A1 (0.59) KCNH2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL10572243 0.83 KCNH2 (0.60) KCNH2KDM4EALDH1A1HPGDHSD17B10

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-4880806-A BACTERICIDES OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1989-11-14 US claimed
US-4880806-A BACTERICIDES OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1989-11-14 US disclosed