SCHEMBL6957821

SCHEMBL6957821

CC(CN1CCOCC1)N1CCOCC1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.52
ALDH1A1 P00352 3/20 0.50
ANPEP P15144 1/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
LMNA P02545 2/20 0.40
KDM4E B2RXH2 2/20 0.38
NPC1 O15118 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
TSHR P16473 1/20 0.36
MAPT P10636 1/20 0.36
CYP2D6 P10635 1/20 0.36

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
SCHEMBL20622554 0.83 ALDH1A1 (0.38) USP2ALDH1A1ANPEPMEN1KMT2A
SCHEMBL26808649 0.82 USP2 (0.44) USP2ALDH1A1ANPEPMEN1KMT2A
SCHEMBL13066093 0.78 USP2 (0.58) USP2ALDH1A1ANPEPMEN1KMT2A
SCHEMBL200033 0.78 USP2 (0.58) USP2ALDH1A1ANPEPMEN1KMT2A
SCHEMBL17828102 0.78 USP2 (0.58) USP2ALDH1A1ANPEPMEN1KMT2A
SCHEMBL11063600 0.78 ALDH1A1 (0.55) ALDH1A1MEN1KMT2ALMNAKDM4E
SCHEMBL9695349 0.78
SCHEMBL23108665 0.76 KMT2A (0.42) USP2ALDH1A1MEN1KMT2ALMNA
Hydrochloric Acid SCHEMBL30622074 0.76 ALDH1A1 (0.59) USP2ALDH1A1ANPEPMEN1KMT2A
SCHEMBL21564194 0.76 KMT2A (0.42) USP2ALDH1A1MEN1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1023267-B1 PYRIDYL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM CERMOL SA (CH) 2003-09-17 EP claimed
EP-1023267-B1 PYRIDYL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM CERMOL SA (CH) 2003-09-17 EP disclosed
US-6482841-B1 Pyridyl compounds and pharmaceutical compositions containing them CERMOL S.A. (CH) 2002-11-19 US disclosed
EP-1023267-A1 PYRIDYL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM CERMOL S.A. (CH) 2000-08-02 EP disclosed
WO-1999019302-A1 PYRIDYL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM CERMOL S.A. (CH) 1999-04-22 WO disclosed
US-4264753-A USING AN ORGANO LITHIUM AND DIHETEROCYCLIC BRIDGED AMINE AS CATALYST SYSTEM THE FIRESTONE TIRE & RUBBER COMPANY (US) 1981-04-28 US disclosed
US-4247418-A ORGANO-LITHIUM COMPOUND WITH A BICYCLIC AMINE THE FIRESTONE TIRE & RUBBER COMPANY (US) 1981-01-27 US disclosed