SCHEMBL9406604

SCHEMBL9406604

COc1cc(N)c2nc3c(cc2c1)CCCC3

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.46
PRNP P04156 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
KDM4E B2RXH2 2/20 0.41
MAPT P10636 4/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
ALDH1A1 P00352 2/20 0.40
RAB9A P51151 2/20 0.40
NFKB1 P19838 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
ACHE P22303 4/20 0.39
BCHE P06276 3/20 0.39
CHRM1 P11229 1/20 0.39
TP53 P04637 3/20 0.38
POLB P06746 3/20 0.38
GRIN1 Q05586 2/20 0.38
GRIN2A Q12879 2/20 0.38
CDK5 Q00535 2/20 0.38
CDK5R1 Q15078 2/20 0.38

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
SCHEMBL9406874 0.76 PRNP (0.45) NPC1PRNPRXFP1KDM4EMAPT
SCHEMBL9406832 0.72 NPC1 (0.56) NPC1KDM4EMAPTSMN1; SMN2ALDH1A1
SCHEMBL29706044 0.72 ACHE (0.54) KDM4EMAPTSMN1; SMN2ALDH1A1ACHE
SCHEMBL3792562 0.71 PRNP (0.42) NPC1PRNPRXFP1KDM4EMAPT
SCHEMBL9406790 0.71 NPC1 (0.74) NPC1KDM4EMAPTSMN1; SMN2ALDH1A1
SCHEMBL9455514 0.69 KDM4E (0.52) NPC1KDM4EMAPTSMN1; SMN2ALDH1A1
SCHEMBL15886676 0.67 PRNP (0.52) NPC1PRNPRXFP1KDM4EMAPT
SCHEMBL23195662 0.66 NPC1 (0.48) NPC1PRNPRXFP1KDM4EMAPT
SCHEMBL441572 0.66 NFKBIA (0.52) KDM4EMAPTSMN1; SMN2ALDH1A1RAB9A
SCHEMBL3294700 0.65 KDM4E (0.47) NPC1PRNPRXFP1KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0328535-B1 THE ADMINISTRATION OF MONOAMINE ACRIDINES IN CHOLINERGIC NEURONAL DEFICIT STATES SUMMERS WILLIAM KOOPMANS (US) 1994-06-01 EP disclosed
EP-0595365-A1 Pharmaceutical composition for the treatment of underlying nonpharmacologically induced nervous system cholinergic deficit state comprising monoamine acridine derivatives Summers, William Koopmans (US) 1994-05-04 EP disclosed
EP-0328535-A4 THE ADMINISTRATION OF MONOAMINE ACRIDINES IN CHOLINERGIC NEURONAL DEFICIT STATES 1991-05-22 EP disclosed
EP-0328535-A1 THE ADMINISTRATION OF MONOAMINE ACRIDINES IN CHOLINERGIC NEURONAL DEFICIT STATES. SUMMERS WILLIAM KOOPMANS 1989-08-23 EP disclosed
US-4816456-A Administration of monoamine acridines in cholinergic neuronal deficit states SUMMERS WILLIAM K (US) 1989-03-28 US disclosed
WO-1988002256-A1 THE ADMINISTRATION OF MONOAMINE ACRIDINES IN CHOLINERGIC NEURONAL DEFICIT STATES SUMMERS WILLIAM KOOPMANS (US) 1988-04-07 WO disclosed