SCHEMBL14060967

SCHEMBL14060967

O=C1CCCN1C1CCN1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.39
BRD4 O60885 1/20 0.37
BRD2 P25440 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CHRNB2 P17787 1/20 0.34
CHRNB4 P30926 1/20 0.34
CHRNA3 P32297 1/20 0.34
CHRNA7 P36544 1/20 0.34
CHRNA4 P43681 1/20 0.34
KDM5A P29375 1/20 0.32
LMNA P02545 1/20 0.31

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
SCHEMBL3867705 0.81 GAA (0.36) MGLLCHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL27828836 0.77 TYMP (0.32) MEN1KMT2ACHRNB2CHRNB4CHRNA3
SCHEMBL25963065 0.74 KDM5A (0.35) MGLLBRD4BRD2CHRNB2CHRNB4
SCHEMBL297012 0.73 HTR2C (0.45) MGLLBRD4BRD2CHRNB2CHRNB4
SCHEMBL6799429 0.73 HTR2C (0.33) MEN1KMT2A
SCHEMBL17185334 0.73
SCHEMBL31467662 0.72 CHRNB2 (0.40) MGLLCHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL2896725 0.72
Hydrochloric Acid SCHEMBL1456315 0.72 HTR2C (0.44) MGLLBRD4BRD2CHRNB2CHRNB4
SCHEMBL11842283 0.71 NOS3 (0.45) MGLLBRD4BRD2KMT2AKDM5A

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-2012159262-A1 SELECTIVE GLYCOSIDASE INHIBITORS AND USES THEREOF ALECTOS THERAPEUTICS INC. (CA) 2012-11-29 WO disclosed