SCHEMBL4966178

SCHEMBL4966178

O=C(C1CC1)N(Cc1ccncc1)c1ccc(Cl)cc1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 3/20 0.60
MAPT P10636 1/20 0.48
CNR1 P21554 1/20 0.47
HTT P42858 1/20 0.45
MAPKAPK2 P49137 1/20 0.45
NR1H4 Q96RI1 1/20 0.44
LMNA P02545 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
BCL2A1 Q16548 4/20 0.43
PKM P14618 2/20 0.42
PDK1 Q15118 1/20 0.42
CPB1 P15086 1/20 0.41
KCNH2 Q12809 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40

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
SCHEMBL4961878 0.86 HTT (0.50) CNR2MAPTHTTMAPKAPK2LMNA
SCHEMBL1336955 0.85 BCL2A1 (0.49) CNR2CNR1HTTMAPKAPK2SMN1; SMN2
SCHEMBL6732007 0.82 HTT (0.49) CNR2CNR1HTTLMNASMN1; SMN2
SCHEMBL23050841 0.79 USP2 (0.49) CNR2CNR1NR1H4LMNASMN1; SMN2
SCHEMBL6730973 0.78 MAPT (0.51) CNR2MAPTPDK1
SCHEMBL6727502 0.77 LMNA (0.53) CNR2MAPTCNR1HTTNR1H4
SCHEMBL15064523 0.75 CNR2 (1.00) CNR2CNR1NR1H4LMNASMN1; SMN2
SCHEMBL4966810 0.74 HTT (0.49) CNR2MAPTHTT
Formic Acid SCHEMBL5034278 0.74 CYP19A1 (0.43) CNR2CNR1HTTNR1H4LMNA
SCHEMBL3057341 0.73 TSHR (0.59) HTTNR1H4SMN1; SMN2PKMPDK1

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-1773780-A4 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORP (US) 2008-01-09 EP claimed
EP-1773780-A2 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS Incyte Corporation (US) 2007-04-18 EP claimed
WO-2006012227-A2 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2006-02-02 WO claimed
EP-1773780-A4 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORP (US) 2008-01-09 EP disclosed
EP-1773780-A2 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS Incyte Corporation (US) 2007-04-18 EP disclosed
WO-2006012227-A2 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2006-02-02 WO disclosed