SCHEMBL1122187

SCHEMBL1122187

O=C(O)CCCCCCCc1cc2ccc(F)cc2[nH]1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.45
GHSR Q92847 1/20 0.44
DAO P14920 1/20 0.43
DDO Q99489 1/20 0.43
PIN1 Q13526 3/20 0.43
GPR17 Q13304 1/20 0.41
FFAR1 O14842 1/20 0.41
PPARG P37231 1/20 0.41
NR3C1 P04150 1/20 0.41
PGR P06401 1/20 0.41
NR3C2 P08235 1/20 0.41
F13A1 P00488 3/20 0.41
MAPT P10636 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
TBXAS1 P24557 1/20 0.40
FLT3 P36888 1/20 0.40
FFAR4 Q5NUL3 1/20 0.40
ITGB3 P05106 1/20 0.40
ITGA2B P08514 1/20 0.40

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
SCHEMBL5637951 0.90 DAO (0.49) DAODDOPIN1GPR17FFAR1
SCHEMBL1122056 0.83 GPR17 (0.48) DAOGPR17FFAR1PPARG
SCHEMBL1121805 0.81 MTNR1A (0.54) DAOPIN1F13A1MAPTRXFP1
SCHEMBL29768662 0.81 MTNR1A (0.54) DAOPIN1F13A1MAPTRXFP1
SCHEMBL28879508 0.81 MTNR1A (0.54) DAOPIN1F13A1MAPTRXFP1
SCHEMBL19182734 0.81 MTNR1A (0.54) DAOPIN1F13A1MAPTRXFP1
SCHEMBL6256471 0.80 MTNR1A (0.55) DAOPIN1MAPTRXFP1FLT3
SCHEMBL11192809 0.79 DAO (0.50) PTGDR2DAODDOPIN1NR3C1
SCHEMBL31381369 0.79 DAO (0.50) PTGDR2DAODDOPIN1NR3C1
SCHEMBL20495205 0.79 GPR17 (0.44) PIN1GPR17FFAR1PPARGFFAR4

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9328373-B2 Detection of Salmonella lactose+ RAMBACH ALAIN (FR) 2016-05-03 US claimed
EP-1931796-B9 DETECTION OF SALMONELLA LACTOSE+ RAMBACH ALAIN (FR) 2011-06-08 EP claimed
EP-1931796-B1 DETECTION OF SALMONELLA LACTOSE+ RAMBACH ALAIN (FR) 2011-02-09 EP claimed
US-20100297690-A1 Detection of salmonella lactose+ RAMBACH ALAIN 2010-11-25 US claimed
US-9328373-B2 Detection of Salmonella lactose+ RAMBACH ALAIN (FR) 2016-05-03 US disclosed
US-20100297690-A1 Detection of salmonella lactose+ RAMBACH ALAIN 2010-11-25 US disclosed