SCHEMBL8117248

SCHEMBL8117248

Cc1c(NN2C=NCC2)cc(C)c2ncccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.41
NPC1 O15118 1/20 0.41
HSP90AA1 P07900 1/20 0.41
SLC40A1 Q9NP59 2/20 0.39
KMT2A Q03164 4/20 0.36
ALDH1A1 P00352 3/20 0.36
LMNA P02545 3/20 0.36
MAPT P10636 2/20 0.36
PAX8 Q06710 1/20 0.36
HTT P42858 2/20 0.35
CCR1 P32246 1/20 0.35
CCR8 P51685 1/20 0.35
SLC6A2 P23975 1/20 0.35
KDM4E B2RXH2 3/20 0.35
ALOX12 P18054 2/20 0.35
ALOX15 P16050 1/20 0.35
NFKB1 P19838 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 1/20 0.35
DYRK1A Q13627 2/20 0.34

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
Hydrochloric Acid SCHEMBL8111472 0.99 L3MBTL1 (0.40) L3MBTL1NPC1HSP90AA1SLC40A1KMT2A
Hydrochloric Acid SCHEMBL8690527 0.82 KDM4E (0.36) L3MBTL1NPC1HSP90AA1SLC40A1KMT2A
Hydrochloric Acid SCHEMBL27402631 0.82 KDM4E (0.36) L3MBTL1NPC1HSP90AA1SLC40A1KMT2A
SCHEMBL7743450 0.80 LRRK2 (0.36) L3MBTL1NPC1HSP90AA1SLC40A1ALDH1A1
Hydrochloric Acid SCHEMBL8692308 0.80
Hydrochloric Acid SCHEMBL8111500 0.79
SCHEMBL7742102 0.77 MAPT (0.39) L3MBTL1HSP90AA1SLC40A1KMT2AALDH1A1
SCHEMBL8111743 0.76 HTR2A (0.32) ALDH1A1LMNAMAPTKDM4E
Hydrochloric Acid SCHEMBL27429683 0.76 MAPT (0.38) L3MBTL1HSP90AA1SLC40A1KMT2AALDH1A1
Hydrochloric Acid SCHEMBL8690223 0.76 MAPT (0.38) L3MBTL1HSP90AA1SLC40A1KMT2AALDH1A1

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-0736020-B1 6-(2-IMIDAZOLINYLAMINO)QUINOLINE COMPOUNDS USEFUL AS ALPHA-2 ADRENOCEPTOR AGONISTS PROCTER & GAMBLE (US) 2000-04-26 EP disclosed
US-5804587-A 6-(2-imidazolinylamino) quinolines useful as alpha-2 adrenoceptor agonists THE PROCTER & GAMBLE COMPANY (US) 1998-09-08 US disclosed
US-5739148-A RESPIRATORY SYSTEM DISORDERS, GASTROINTESTINAL DISORDERS, VISION DISORDERS THE PROCTER & GAMBLE COMPANY 1998-04-14 US disclosed
CN-1137793-A 6- (2-imidazolinylamino) quinoline compounds as alpha 2 adrenoceptor agonists PROCTER & GAMBLE (US) 1996-12-11 CN disclosed
US-5578607-A 6-(2-imidazolinylamino)quinoline compounds useful as alpha-2 adrenoceptor agonists THE PROCTER & GAMBLE COMPANY (US) 1996-11-26 US disclosed
EP-0736020-A1 6-(2-IMIDAZOLINYLAMINO)QUINOLINE COMPOUNDS USEFUL AS ALPHA-2 ADRENOCEPTOR AGONISTS THE PROCTER & GAMBLE COMPANY (US) 1996-10-09 EP disclosed
WO-1995016683-A1 6-(2-IMIDAZOLINYLAMINO)QUINOLINE COMPOUNDS USEFUL AS ALPHA-2 ADRENOCEPTOR AGONISTS THE PROCTER & GAMBLE COMPANY (US) 1995-06-22 WO disclosed