SCHEMBL14535528

SCHEMBL14535528

CBc1cccc(Cn2cc(C(=O)c3ccccc3C=O)c(=O)c3ccccc32)n1

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACKR3 P25106 1/20 0.52
CNR2 P34972 11/20 0.51
TP53 P04637 3/20 0.44
LMNA P02545 1/20 0.42
MAPT P10636 2/20 0.40

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
SCHEMBL1549067 0.86 ACKR3 (0.66) ACKR3CNR2TP53LMNA
SCHEMBL14535572 0.86 CNR2 (0.53) ACKR3CNR2TP53LMNA
SCHEMBL12707327 0.85 ACKR3 (0.52) ACKR3CNR2TP53MAPT
SCHEMBL13069039 0.80 ACKR3 (0.55) ACKR3CNR2TP53LMNAMAPT
SCHEMBL13069582 0.79 ACKR3 (0.57) ACKR3CNR2TP53LMNAMAPT
SCHEMBL13069569 0.79 ACKR3 (0.52) ACKR3CNR2TP53LMNAMAPT
SCHEMBL13069028 0.78 ACKR3 (0.48) ACKR3CNR2TP53LMNAMAPT
SCHEMBL14535540 0.77 ACKR3 (0.51) ACKR3CNR2TP53LMNAMAPT
SCHEMBL14535385 0.76 ACKR3 (0.62) ACKR3CNR2TP53LMNAMAPT
SCHEMBL14535539 0.75 CNR2 (0.58) ACKR3CNR2TP53LMNA

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-2007059108-A2 SUBSTITUTED QUINOLONES AND METHODS OF USE CHEMOCENTRYX, INC. (US) 2007-05-24 WO disclosed