SCHEMBL8860906

SCHEMBL8860906

O=c1ccc2cc(OCCCCNCc3ccccc3)ccc2[nH]1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 13/20 0.59
PPARG P37231 1/20 0.57
KDM4E B2RXH2 2/20 0.51
MAPK1 P28482 1/20 0.51
BCHE P06276 1/20 0.50
MAOA P21397 1/20 0.50
ACHE P22303 1/20 0.50
MAOB P27338 1/20 0.50
P4HB P07237 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
PKM P14618 1/20 0.50
FAAH O00519 1/20 0.49
POLB P06746 1/20 0.47

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
SCHEMBL5701156 0.82 PPARG (0.83) DRD2PPARGKDM4EMAPK1BCHE
SCHEMBL7801986 0.79 DRD2 (0.50) DRD2KDM4EFAAH
SCHEMBL3373971 0.79 MAOB (0.65) PPARGKDM4EMAOAACHEMAOB
SCHEMBL5701304 0.78 PPARG (0.91) DRD2PPARGKDM4EMAPK1BCHE
SCHEMBL7803132 0.78 PDE3B (0.49) DRD2KDM4EFAAH
SCHEMBL9319380 0.78 PPARG (0.74) DRD2PPARGKDM4EMAPK1BCHE
Chlorobenzene SCHEMBL11276027 0.78 F11 (0.47) DRD2KDM4EFAAH
SCHEMBL20029447 0.77 DRD2 (0.65) DRD2
SCHEMBL11268673 0.77 KDM4E (0.46) DRD2KDM4EACHEMAOBFAAH
SCHEMBL8860585 0.77 PDE3B (0.52) DRD2KDM4EFAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5658926-A ANTICOAGULANTS, ANTIHISTAMINES, ANTIARRHYTHMIC, CARTIOTONIC AGENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-08-19 US disclosed
US-5506239-A Carbostyril derivative and platelets aggregation inhibitory agent OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1996-04-09 US disclosed
EP-0569592-A1 CARBOSTYRIL DERIVATIVE AND PLATELET AGGLUTINATION INHIBITOR OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1993-11-18 EP disclosed