SCHEMBL5884663

SCHEMBL5884663

CON=Cc1c(C)cc(OCCC2CCN(c3ccc(C)nn3)CC2)cc1C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 2/20 0.35
NR1I2 O75469 1/20 0.33
PPARG P37231 2/20 0.32
PPARD Q03181 2/20 0.32
PPARA Q07869 1/20 0.32
OGA O60502 1/20 0.32
DRD2 P14416 1/20 0.31
DRD4 P21917 1/20 0.31
TEAD1 P28347 1/20 0.31
TEAD3 Q99594 1/20 0.31
MAPT P10636 1/20 0.31
ENPP1 P22413 1/20 0.31
RET P07949 1/20 0.31
ADK P55263 1/20 0.31
SSTR2 P30874 1/20 0.31
SLC2A1 P11166 1/20 0.30
CHRM4 P08173 1/20 0.30
ACACB O00763 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL5884899 0.90 GPR119 (0.36) GPR119NR1I2PPARGPPARDPPARA
SCHEMBL5884665 0.88 PPARG (0.38) GPR119NR1I2PPARGPPARDPPARA
SCHEMBL5884362 0.86 NR1I2 (0.38) GPR119NR1I2TEAD1TEAD3MAPT
SCHEMBL5884326 0.84 NPC1 (0.38) GPR119PPARGPPARDPPARATEAD1
SCHEMBL5884479 0.82 CTSS (0.35) NR1I2PPARGPPARDPPARAOGA
SCHEMBL5884356 0.81 HRH3 (0.38) GPR119NR1I2DRD2MAPT
SCHEMBL5884729 0.80 NPC1 (0.37) SMN1; SMN2GLS
SCHEMBL5884402 0.79 OPRK1 (0.33) NR1I2PPARGPPARDPPARAOGA
SCHEMBL5884543 0.79 OPRK1 (0.38) GPR119NR1I2PPARGPPARDPPARA
SCHEMBL5884805 0.78 NR1I2 (0.32) NR1I2GLS

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-7078403-B1 Antiviral agents BIOTA SCIENTIFIC MANAGEMENT PTY LTD. (AU) 2006-07-18 US claimed