SCHEMBL1121944

SCHEMBL1121944

CCCCCCC(C(=O)O)c1[nH]c2ccccc2c1Br

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
OXER1 Q8TDS5 1/20 0.42
KDM4E B2RXH2 5/20 0.41
ALDH1A1 P00352 5/20 0.41
HPGD P15428 4/20 0.41
HSD17B10 Q99714 4/20 0.41
GAA P10253 2/20 0.40
CTSV O60911 1/20 0.40
CTSL P07711 1/20 0.40
MGAM O43451 1/20 0.40
SI P14410 1/20 0.40
MGAM2 Q2M2H8 1/20 0.40
USP2 O75604 1/20 0.40
LMNA P02545 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL28860693 0.74 MEN1 (0.59) KDM4EGAAMGAMSIMGAM2
SCHEMBL1121804 0.72 DRD2 (0.46) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL19182733 0.72 DRD2 (0.46) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL2554332 0.72 TBXAS1 (0.54) ALDH1A1LMNA
SCHEMBL1290373 0.72 TBXAS1 (0.54) ALDH1A1LMNA
SCHEMBL2551104 0.72 TBXAS1 (0.54) ALDH1A1LMNA
SCHEMBL1518057 0.72 TBXAS1 (0.54) ALDH1A1LMNA
SCHEMBL2550963 0.72 TBXAS1 (0.54) ALDH1A1LMNA
SCHEMBL2552649 0.72 TBXAS1 (0.54) ALDH1A1LMNA
SCHEMBL2555641 0.72 TBXAS1 (0.54) ALDH1A1LMNA

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