SCHEMBL7923449

SCHEMBL7923449

ClCCOCCN(c1ccccc1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 3/20 0.38
MTNR1A P48039 3/20 0.37
MTNR1B P49286 3/20 0.37
NPC1 O15118 1/20 0.34
ALDH1A1 P00352 1/20 0.34
POLB P06746 1/20 0.34
HTT P42858 1/20 0.34
RAB9A P51151 1/20 0.34
KMT2A Q03164 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
USP2 O75604 1/20 0.34
PPARG P37231 1/20 0.34
PPARA Q07869 1/20 0.34
REN P00797 3/20 0.33
CTSD P07339 1/20 0.33
CTSE P14091 1/20 0.33
PGC P20142 1/20 0.33
ADRB2 P07550 1/20 0.33
ADRB1 P08588 1/20 0.33
HRH3 Q9Y5N1 1/20 0.32

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
SCHEMBL12918858 0.87 KCNH2 (0.42) KCNH2MTNR1AMTNR1BKMT2AUSP2
SCHEMBL7926319 0.87 KCNA3 (0.38) KCNH2MTNR1AMTNR1BPPARGPPARA
SCHEMBL3637570 0.78 KCNH2 (0.45) KCNH2MTNR1AMTNR1BNPC1ALDH1A1
Hydrochloric Acid SCHEMBL11683567 0.76 KCNH2 (0.44) KCNH2MTNR1AMTNR1BNPC1ALDH1A1
SCHEMBL5074222 0.74 KCNH2 (0.44) KCNH2MTNR1AMTNR1BNPC1ALDH1A1
SCHEMBL25335390 0.72 MEN1 (0.46) KCNH2MTNR1AMTNR1BALDH1A1HTT
SCHEMBL6547425 0.72 KCNH2 (0.43) KCNH2MTNR1AMTNR1BNPC1ALDH1A1
SCHEMBL4194791 0.72 KCNH2 (0.52) KCNH2MTNR1AMTNR1BALDH1A1NPSR1
SCHEMBL6287300 0.72 KDM4E (0.44) MTNR1AMTNR1BNPC1ALDH1A1RAB9A
SCHEMBL18590697 0.71 KCNA5 (0.41) MTNR1AMTNR1BNPC1ALDH1A1POLB

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
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
EP-0502031-A1 N-SUBSTITUTED AZAHETEROCYCLIC CARBOXYLIC ACIDS AND A PHARMACEUTICAL COMPOSITION. NOVO NORDISK AS (DK) 1992-09-09 EP disclosed
WO-1991007389-A1 N-SUBSTITUTED AZAHETEROCYCLIC CARBOXYLIC ACIDS AND A PHARMACEUTICAL COMPOSITION NOVO NORDISK A/S (DK) 1991-05-30 WO disclosed