SCHEMBL4745951

SCHEMBL4745951

O=C(O)c1ccc(NCc2cccc(Oc3cccc(Cl)c3)c2)cc1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 15/20 0.60
GNA15 P30679 1/20 0.58
PTGER3 P43115 1/20 0.58
FFAR4 Q5NUL3 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
RXRA P19793 1/20 0.55
RXRB P28702 1/20 0.55
RXRG P48443 1/20 0.55
LPAR1 Q92633 1/20 0.53
LPAR5 Q9H1C0 1/20 0.53
ADRB3 P13945 1/20 0.53

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
SCHEMBL14043994 0.91 FFAR1 (0.65) FFAR1GNA15PTGER3FFAR4TDP1
SCHEMBL4748821 0.90 FFAR1 (0.74) FFAR1GNA15PTGER3FFAR4TDP1
SCHEMBL11248670 0.88 HIF1A (0.58) RXRARXRBRXRGADRB3
SCHEMBL14044092 0.88 FFAR1 (0.60) FFAR1GNA15PTGER3FFAR4TDP1
SCHEMBL14044103 0.85 HIF1A (0.66) FFAR1GNA15PTGER3FFAR4TDP1
SCHEMBL14044096 0.85 FFAR1 (0.60) FFAR1GNA15PTGER3FFAR4TDP1
SCHEMBL14043645 0.84 FFAR1 (0.57) FFAR1GNA15PTGER3FFAR4TDP1
SCHEMBL14044095 0.84 FFAR1 (0.65) FFAR1GNA15PTGER3FFAR4TDP1
SCHEMBL14043908 0.84 FFAR1 (0.65) FFAR1GNA15PTGER3FFAR4TDP1
SCHEMBL14044105 0.82 MAPK14 (0.58) FFAR1GNA15PTGER3FFAR4TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008121570-A1 COMPOUNDS AND METHODS FOR MODULATING G PROTEIN-COUPLED RECEPTORS IRM LLC (BM) 2008-10-09 WO disclosed