SCHEMBL14775776

SCHEMBL14775776

Fc1ccc(COc2ccc(Cl)cc2CBr)cc1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 3/20 0.55
SMN1; SMN2 Q16637 2/20 0.54
ALDH1A1 P00352 2/20 0.54
LMNA P02545 1/20 0.54
SLC6A4 P31645 2/20 0.53
SLC6A2 P23975 1/20 0.52
SLC6A3 Q01959 1/20 0.52
CCR5 P51681 7/20 0.50
MAPK14 Q16539 1/20 0.49
STAT3 P40763 1/20 0.49
TP53 P04637 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
PKM P14618 1/20 0.44
MRGPRX4 Q96LA9 1/20 0.43

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
SCHEMBL18783656 0.91 CCR5 (0.59) PTGER1SLC6A4CCR5STAT3MRGPRX4
SCHEMBL14774727 0.88 STAT3 (0.46) PTGER1SMN1; SMN2ALDH1A1LMNASLC6A4
SCHEMBL14774657 0.87 SMN1; SMN2 (0.49) PTGER1SMN1; SMN2ALDH1A1LMNASLC6A4
SCHEMBL562155 0.84 PTGER1 (0.55) PTGER1SLC6A4CCR5STAT3
SCHEMBL14774575 0.84 SLC6A4 (0.56) PTGER1SLC6A4CCR5STAT3MRGPRX4
SCHEMBL14774767 0.84 CCR5 (0.47) PTGER1SMN1; SMN2ALDH1A1LMNASLC6A4
SCHEMBL14774744 0.84 MEN1 (0.48) PTGER1SMN1; SMN2LMNASLC6A4MEN1
SCHEMBL14774604 0.83 MEN1 (0.62) PTGER1SMN1; SMN2ALDH1A1CCR5STAT3
SCHEMBL30866179 0.83 MEN1 (0.62) PTGER1SMN1; SMN2ALDH1A1CCR5STAT3
SCHEMBL14774605 0.82 PTGER1 (0.46) PTGER1SMN1; SMN2ALDH1A1LMNAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2766344-B1 EP1 RECEPTOR LIGANDS ESTEVE LABOR DR (ES) 2017-05-03 EP disclosed
EP-2570125-A1 Ep1 receptor ligands Almirall, S.A. (ES) 2013-03-20 EP disclosed