SCHEMBL9404282

SCHEMBL9404282

Clc1nc(N2CCOCC2)c2c(Br)cccc2n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.50
SMN1; SMN2 Q16637 3/20 0.46
KDM4E B2RXH2 6/20 0.44
MAPT P10636 3/20 0.44
MAPK1 P28482 3/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
CASP1 P29466 1/20 0.43
HSD17B10 Q99714 1/20 0.43
ALDH1A1 P00352 6/20 0.42
HPGD P15428 2/20 0.42
GAA P10253 2/20 0.42
LMNA P02545 2/20 0.42
MAPK10 P53779 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
GLA P06280 1/20 0.42
PIK3CA P42336 2/20 0.41
PTK2 Q05397 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
SCHEMBL7326820 0.86 POLB (0.53) POLBSMN1; SMN2KDM4EMAPTMAPK1
SCHEMBL9404425 0.83 POLB (0.50) POLBSMN1; SMN2KDM4EMAPTMAPK1
SCHEMBL9404448 0.83 POLB (0.50) POLBSMN1; SMN2KDM4EMAPTMAPK1
SCHEMBL9404295 0.80 KDM4E (0.48) POLBSMN1; SMN2KDM4EMAPTMAPK1
SCHEMBL9404529 0.80 CYP1A2 (0.51) POLBSMN1; SMN2KDM4EMAPTMAPK1
SCHEMBL18421140 0.78 SMN1; SMN2 (0.53) POLBSMN1; SMN2KDM4EMAPTMAPK1
SCHEMBL4792395 0.78 ALDH1A1 (0.55) POLBSMN1; SMN2KDM4EMAPTMAPK1
SCHEMBL2726482 0.78 HRH4 (0.50) POLBSMN1; SMN2KDM4EMAPTMAPK1
SCHEMBL4095134 0.77 KDM4E (0.69) POLBSMN1; SMN2KDM4EMAPTMAPK1
SCHEMBL2276716 0.73 PIK3CA (0.62) POLBPIK3CA

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-5371080-A Central nervous system disorders NOVO NORDISK A/S 1994-12-06 US disclosed
EP-0619820-A1 IMIDAZOQUINAZOLINE COMPOUNDS AND THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1994-10-19 EP disclosed
WO-1993013103-A1 IMIDAZOQUINAZOLINE COMPOUNDS AND THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1993-07-08 WO disclosed