SCHEMBL1122179

SCHEMBL1122179

CCCCCCCC(=O)Oc1cc2cc(I)ccc2[nH]1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.41
HTR1B P28222 1/20 0.41
PDGFRB P09619 1/20 0.40
PDGFRA P16234 1/20 0.40
ALOX15 P16050 1/20 0.40
KMT2A Q03164 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HRH4 Q9H3N8 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38
POLM Q9NP87 1/20 0.38
POLK Q9UBT6 1/20 0.38
POLL Q9UGP5 1/20 0.38
POLH Q9Y253 1/20 0.38
TOP2A P11388 2/20 0.37
CA2 P00918 2/20 0.37
PLA2G4A P47712 1/20 0.36
DGKA P23743 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL1121978 0.85 HDAC3 (0.45) HTR1AHTR1BPDGFRBPDGFRAALOX15
SCHEMBL1122185 0.83 PDGFRB (0.51) PDGFRBPDGFRAALOX15KMT2ASMN1; SMN2
SCHEMBL29933814 0.81 PDGFRB (0.52) PDGFRBPDGFRAALOX15KMT2ASMN1; SMN2
SCHEMBL1122030 0.77 ALOX15 (0.53) PDGFRBALOX15
SCHEMBL1121871 0.77 NAAA (0.40) HTR1AHTR1BALOX15KMT2ASMN1; SMN2
SCHEMBL15548382 0.75 ALOX15 (0.62) ALOX15KMT2ASMN1; SMN2POLMPOLK
SCHEMBL15558955 0.75 ALOX15 (0.62) ALOX15KMT2ASMN1; SMN2POLMPOLK
SCHEMBL1122066 0.75 HTR1B (0.52) HTR1AHTR1BALOX15KMT2APOLM
SCHEMBL1121835 0.75 CYP1A2 (0.38) HTR1AHTR1BALOX15KMT2ASMN1; SMN2
SCHEMBL15558684 0.74 ALOX15 (0.63) ALOX15KMT2ASMN1; SMN2POLMPOLK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4794627-B2 2011-10-19 JP 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
EP-1931796-A1 DETECTION OF SALMONELLA LACTOSE+ Rambach, Alain (FR) 2008-06-18 EP claimed
WO-2007023185-A1 DETECTION OF SALMONELLA LACTOSE+ RAMBACH ALAIN (FR) 2007-03-01 WO claimed
EP-1931796-B9 DETECTION OF SALMONELLA LACTOSE+ RAMBACH ALAIN (FR) 2011-06-08 EP disclosed
EP-1931796-B1 DETECTION OF SALMONELLA LACTOSE+ RAMBACH ALAIN (FR) 2011-02-09 EP disclosed
EP-1931796-A1 DETECTION OF SALMONELLA LACTOSE+ Rambach, Alain (FR) 2008-06-18 EP disclosed
WO-2007023185-A1 DETECTION OF SALMONELLA LACTOSE+ RAMBACH ALAIN (FR) 2007-03-01 WO disclosed