SCHEMBL1121895

SCHEMBL1121895

O=C(O)CCCCCCCc1cc2ccc(Cl)c(Cl)c2[nH]1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 2/20 0.40
F13A1 P00488 3/20 0.40
MAPT P10636 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
LTB4R Q15722 1/20 0.36
FFAR1 O14842 1/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.36
CYP1A2 P05177 1/20 0.35
PRKAG1 P54619 1/20 0.35
PRKAA2 P54646 1/20 0.35
PRKAA1 Q13131 1/20 0.35
PRKAB1 Q9Y478 1/20 0.35
GPR17 Q13304 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
SCHEMBL26912992 0.89 FFAR1 (0.41) FFAR1CYP1A2PRKAG1PRKAA2PRKAA1
SCHEMBL1121990 0.80 F13A1 (0.41) TBXAS1F13A1MAPTRXFP1LTB4R
SCHEMBL26912276 0.77 CYP1A2 (0.39) MAPTCYP1A2
SCHEMBL1122056 0.77 GPR17 (0.48) LTB4RFFAR1GPR17
SCHEMBL26912587 0.77 MTNR1A (0.44) RXFP1
SCHEMBL26912733 0.76 EGFR (0.42) MAPT
SCHEMBL10593440 0.74 SIRT1 (0.56) LTB4RFFAR1GPR17
SCHEMBL26912724 0.73 RHEB (0.38)
SCHEMBL1121937 0.72 PRKAG1 (0.43) TBXAS1F13A1FFAR1PRKAG1PRKAA2
SCHEMBL19182734 0.71 MTNR1A (0.54) F13A1MAPTRXFP1CYP1A2

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