SCHEMBL4639692

SCHEMBL4639692

CCCNC(=O)N1CCNCC1N

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.40
CHRNB2 P17787 1/20 0.39
CHRNB4 P30926 1/20 0.39
CHRNA3 P32297 1/20 0.39
CHRNA7 P36544 1/20 0.39
CHRNA4 P43681 1/20 0.39
KMT2A Q03164 3/20 0.36
DPP4 P27487 1/20 0.34
MEN1 O00255 1/20 0.33
CYP2C19 P33261 1/20 0.33
GNAI3 P08754 1/20 0.33
GNAO1 P09471 1/20 0.33
GNAI1 P63096 1/20 0.33
HTT P42858 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
SIGMAR1 Q99720 1/20 0.31
KDM4E B2RXH2 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
HCRTR2 O43614 1/20 0.31
EPHX1 P07099 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
SCHEMBL5195326 0.80 LMNA (0.39) LMNACHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL27862405 0.73 GNAI3 (0.47) KMT2AMEN1GNAI3GNAO1GNAI1
SCHEMBL10818831 0.72 KMT2A (0.55) LMNAKMT2AMEN1CYP2C19HTT
SCHEMBL18231595 0.72 CHRNB2 (0.44) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL9712280 0.71 GNAI3 (0.48) GNAI3GNAO1GNAI1NPSR1EPHX1
SCHEMBL30851411 0.71 CA1 (0.33) LMNACHRNB2CHRNA3CHRNA4KMT2A
SCHEMBL3460148 0.71 KDM4E (0.35) CHRNB2CHRNA3CHRNA4KMT2AKDM4E
SCHEMBL19722768 0.69
Hydrochloric Acid SCHEMBL6435714 0.68 DPP4 (0.30) KMT2ADPP4MEN1
SCHEMBL4592734 0.68 POLB (0.56) KMT2AMEN1CYP2C19KDM4E

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-1879859-A2 DIARYLSULFONE SULFONAMIDES AND USE THEROF Wyeth a Corporation of the State of Delaware (US) 2008-01-23 EP claimed
WO-2006124875-A2 DIARYLSULFONE SULFONAMIDES AND USE THEROF WYETH (US) 2006-11-23 WO claimed