SCHEMBL14535376

SCHEMBL14535376

Bc1cccc(Cn2cc(C(=C)c3ccccc3C)c(=O)c3ccccc32)n1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ACKR3 P25106 1/20 0.52
CNR2 P34972 7/20 0.43
LMNA P02545 1/20 0.41
TP53 P04637 1/20 0.41
CHRM1 P11229 1/20 0.41
POLB P06746 1/20 0.40
SMN1; SMN2 Q16637 1/20 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
SCHEMBL12707262 0.82 ACKR3 (0.46) ACKR3CNR2LMNATP53CHRM1
SCHEMBL12707248 0.80 ACKR3 (0.79) ACKR3CNR2TP53POLBSMN1; SMN2
SCHEMBL14535369 0.80 ACKR3 (0.46) ACKR3CNR2LMNATP53
SCHEMBL13766655 0.79 ACKR3 (0.58) ACKR3CNR2LMNATP53POLB
SCHEMBL13069127 0.79 CNR2 (0.58) ACKR3CNR2LMNATP53CHRM1
SCHEMBL12707429 0.79 ACKR3 (0.48) ACKR3CNR2LMNATP53CHRM1
SCHEMBL12707164 0.79 ACKR3 (0.62) ACKR3CNR2LMNATP53POLB
SCHEMBL13069427 0.78 ACKR3 (0.55) ACKR3CNR2LMNATP53POLB
SCHEMBL14535532 0.78 SMN1; SMN2 (0.59) ACKR3CNR2LMNATP53CHRM1
SCHEMBL14535385 0.78 ACKR3 (0.62) ACKR3CNR2LMNATP53POLB

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