SCHEMBL7413016

SCHEMBL7413016

CC(C)(C)OC(=O)CN1CCC(CCCO)CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR4 Q13639 1/20 0.40
GPR119 Q8TDV5 8/20 0.37
FAAH O00519 1/20 0.36
WNT1 P04628 1/20 0.36
GSK3B P49841 1/20 0.36
DYRK1A Q13627 1/20 0.36
PLA2G10 O15496 1/20 0.35
PLA2G5 P39877 1/20 0.35
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35
CHRM5 P08912 1/20 0.35
CHRM1 P11229 1/20 0.35
DRD2 P14416 1/20 0.35
CHRM3 P20309 1/20 0.35
DRD4 P21917 1/20 0.35
DRD3 P35462 1/20 0.35
AKR1C3 P42330 1/20 0.34
CNR1 P21554 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
NR1H2 P55055 1/20 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
SCHEMBL18173283 0.86 NR1H2 (0.43) HTR4WNT1GSK3BDYRK1APLA2G10
SCHEMBL24709214 0.82 HTR4 (0.40) HTR4FAAHWNT1GSK3BDYRK1A
SCHEMBL4700650 0.81 HTR4 (0.41) HTR4WNT1GSK3BDYRK1APLA2G10
SCHEMBL6217337 0.81 HTR4 (0.41) HTR4WNT1GSK3BDYRK1APLA2G10
SCHEMBL27060441 0.81 GPR119 (0.39) HTR4GPR119FAAHWNT1GSK3B
SCHEMBL24709213 0.80 HTR4 (0.41) HTR4WNT1GSK3BDYRK1APLA2G10
SCHEMBL13698802 0.79 SMN1; SMN2 (0.41) HTR4WNT1GSK3BDYRK1APLA2G10
SCHEMBL572705 0.79 CHRM2 (0.41) HTR4WNT1GSK3BDYRK1APLA2G10
SCHEMBL560636 0.78 GPR119 (0.55) GPR119FAAHNR1H2
SCHEMBL3470166 0.78 PLA2G10 (0.41) HTR4WNT1GSK3BDYRK1APLA2G10

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
EP-1173415-A1 DIPHENYLUREA DERIVATIVES AstraZeneca AB (SE) 2002-01-23 EP disclosed
WO-2000064866-A1 DIPHENYLUREA DERIVATIVES ASTRAZENECA AB (SE) 2000-11-02 WO disclosed