SCHEMBL5762181

SCHEMBL5762181

CN1C(=O)C(N)CCCC1c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 2/20 0.49
CHRNB2 P17787 1/20 0.49
CHRNB4 P30926 1/20 0.49
CHRNA3 P32297 1/20 0.49
CHRNA4 P43681 1/20 0.49
TSHR P16473 1/20 0.42
KMT2A Q03164 1/20 0.42
ALDH1A1 P00352 2/20 0.42
ATM Q13315 1/20 0.42
RIPK1 Q13546 1/20 0.40
BRD4 O60885 3/20 0.39
GRM5 P41594 1/20 0.39

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
SCHEMBL4836432 1.00 CHRNA7 (0.49) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL4834059 1.00 CHRNA7 (0.49) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL4839373 1.00 CHRNA7 (0.49) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL4837331 1.00 CHRNA7 (0.49) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL3245742 0.76 RAMP1 (0.43) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL4212886 0.76 RAMP1 (0.43) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL3240278 0.76 RIPK1 (0.41) RIPK1
SCHEMBL5823194 0.76 RAMP1 (0.43) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL4960142 0.76 RIPK1 (0.40) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL1240108 0.75 KDM4E (0.54) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4

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-1636196-A1 NOVEL LACTAMS AND USES THEREOF AstraZeneca AB (SE) 2006-03-22 EP disclosed
WO-2004080983-A1 NOVEL LACTAMS AND USES THEREOF ASTRAZENECA AB (SE) 2004-09-23 WO disclosed