SCHEMBL13069040

SCHEMBL13069040

Bc1cccc(Cn2cc(C(=O)c3ccc(OC)c(C)c3)c(=O)c3cccnc32)c1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.48
MAPT P10636 6/20 0.47
TP53 P04637 4/20 0.47
POLB P06746 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
RXFP1 Q9HBX9 2/20 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
SCHEMBL1072835 0.90 MAPT (0.47) GAAMAPTTP53POLBSMN1; SMN2
SCHEMBL1083426 0.89 MAPT (0.47) GAAMAPTTP53POLBSMN1; SMN2
SCHEMBL12706981 0.88 TP53 (0.47) GAAMAPTTP53POLBSMN1; SMN2
SCHEMBL13762949 0.83 ACKR3 (0.50) MAPTTP53POLBSMN1; SMN2RXFP1
SCHEMBL1549596 0.82 ACKR3 (0.62) MAPTTP53POLBSMN1; SMN2RXFP1
SCHEMBL1074684 0.80 ACKR3 (0.47) MAPTTP53POLBSMN1; SMN2RXFP1
SCHEMBL3399997 0.80 ACKR3 (0.47) GAAMAPTTP53POLBSMN1; SMN2
SCHEMBL13069583 0.78 ACKR3 (0.44) GAAMAPTTP53POLBRXFP1
SCHEMBL13762953 0.75 THRB (0.46) GAAMAPTTP53POLBRXFP1
SCHEMBL14455249 0.75 POLB (0.64) GAAMAPTTP53POLBSMN1; SMN2

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-1954274-B1 SUBSTITUTED QUINOLONES AND METHODS OF USE CHEMOCENTRYX INC (US) 2010-11-03 EP disclosed
WO-2007059108-A2 SUBSTITUTED QUINOLONES AND METHODS OF USE CHEMOCENTRYX, INC. (US) 2007-05-24 WO disclosed