SCHEMBL7923680

SCHEMBL7923680

CCOC(=O)C1CCCN(CCOCC=C(c2ccccc2)c2cccc(C)c2)C1

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.54
NPC1 O15118 1/20 0.54
RAB9A P51151 1/20 0.54
KMT2A Q03164 1/20 0.54
KDM4E B2RXH2 1/20 0.54
ALDH1A1 P00352 1/20 0.54
HTR7 P34969 2/20 0.52
HTR1A P08908 1/20 0.52
DRD2 P14416 1/20 0.52
HTR2A P28223 1/20 0.52

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
SCHEMBL7923673 1.00 MEN1 (0.54) MEN1NPC1RAB9AKMT2AKDM4E
SCHEMBL8908108 1.00 MEN1 (0.54) MEN1NPC1RAB9AKMT2AKDM4E
SCHEMBL7923676 1.00 MEN1 (0.54) MEN1NPC1RAB9AKMT2AKDM4E
SCHEMBL7925412 0.94 KDM4E (0.60) KDM4EALDH1A1
SCHEMBL7925406 0.94 KDM4E (0.60) KDM4EALDH1A1
SCHEMBL7923196 0.91 KDM4E (0.58) KDM4EALDH1A1
SCHEMBL7923193 0.91 KDM4E (0.58) KDM4EALDH1A1
SCHEMBL7923200 0.91 KDM4E (0.58) KDM4EALDH1A1
SCHEMBL8909748 0.91 KDM4E (0.58) KDM4EALDH1A1
SCHEMBL8909444 0.91 SLC6A1 (0.61) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6174898-B1 TREATING FILARIAE IN LYMPHATIC SYSTEM BY ADMINISTERING N-SUBSTITUTED AZAHETEROCYCLIC CARBOXYLIC ACIDS AND ESTERS IN WHICH A SUBSTITUTED ALKYL CHAIN FORMS PART OF N-SUBSTITUENT AND SALTS NOVO NORDISK A/S (DK) 2001-01-16 US disclosed
EP-0858339-A1 A METHOD OF TREATING FILARIAE NOVO NORDISK A/S (DK) 1998-08-19 EP disclosed
EP-0502031-B1 N-SUBSTITUTED AZAHETEROCYCLIC CARBOXYLIC ACIDS AND A PHARMACEUTICAL COMPOSITION NOVO NORDISK AS (DK) 1997-08-20 EP disclosed
WO-1997017073-A1 A METHOD OF TREATING FILARIAE NOVO NORDISK A/S (DK) 1997-05-15 WO disclosed
US-5198451-A Treatment of epilepsy, inhibitors of gamma-aminobutyric acid uptake from synaptic cleft NOVO NORDISK A/S (DK) 1993-03-30 US disclosed