SCHEMBL7534613

SCHEMBL7534613

C1CCONCCOCCOCCNCCOC1

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.57
KMT2A Q03164 1/20 0.57
KDM4E B2RXH2 1/20 0.50
GAA P10253 1/20 0.50
CYP2C9 P11712 1/20 0.50
ALDH1A1 P00352 1/20 0.38
HTT P42858 1/20 0.31
LMNA P02545 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
Morpholine SCHEMBL10426239 0.88 MEN1 (0.52) MEN1KMT2AKDM4EGAACYP2C9
Morpholine SCHEMBL308308 0.85 MEN1 (0.55) MEN1KMT2AKDM4EGAACYP2C9
SCHEMBL20522969 0.85
SCHEMBL11557802 0.85 MEN1 (0.61) MEN1KMT2AKDM4EGAACYP2C9
SCHEMBL9400799 0.82 MEN1 (0.75) MEN1KMT2AKDM4EGAACYP2C9
SCHEMBL5314604 0.82 MEN1 (0.75) MEN1KMT2AKDM4EGAACYP2C9
Morpholine SCHEMBL1932496 0.82 MEN1 (0.73) MEN1KMT2AKDM4EGAACYP2C9
SCHEMBL9868765 0.81 MEN1 (0.38) MEN1KMT2AKDM4EGAACYP2C9
SCHEMBL23742743 0.79 MEN1 (0.71) MEN1KMT2AKDM4EGAACYP2C9
SCHEMBL9400796 0.79 MEN1 (0.71) MEN1KMT2AKDM4EGAACYP2C9

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6436919-B1 LOCAL ANESTHETICS THAT HAVE LONGER DURATION OF ACTION WHILE REDUCING UNDESIRED SIDE EFFECTS THERAVANCE INC. 2002-08-20 US disclosed
EP-1216243-A1 QUINAZOLINONES AND ANALOGUES AND THEIR USE AS LOCAL ANESTHETICS Advanced Medicine, Inc. (US) 2002-06-26 EP disclosed
WO-2001025234-A1 QUINAZOLINONES AND ANALOGUES AND THEIR USE AS LOCAL ANESTHETICS ADVANCED MEDICINE, INC. (US) 2001-04-12 WO disclosed