SCHEMBL4564941

SCHEMBL4564941

CC(Nc1c([N+](=O)[O-])c(Cl)nc2ccccc12)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.45
HTT P42858 4/20 0.45
ALDH1A1 P00352 3/20 0.45
LMNA P02545 3/20 0.45
CCNE2 O96020 3/20 0.44
CCNE1 P24864 3/20 0.44
CDK2 P24941 3/20 0.44
CDK4 P11802 2/20 0.44
CCND1 P24385 2/20 0.44
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
GALR3 O60755 1/20 0.42
NR2F2 P24468 1/20 0.42
GAA P10253 1/20 0.42
GPR55 Q9Y2T6 1/20 0.42
CRHBP P24387 1/20 0.41
CRHR2 Q13324 1/20 0.41
MAPK1 P28482 3/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL214937 1.00 MAPT (0.45) MAPTHTTALDH1A1LMNACCNE2
SCHEMBL212396 1.00 MAPT (0.45) MAPTHTTALDH1A1LMNACCNE2
SCHEMBL24732887 0.85 CACNA2D1 (0.41) MAPTALDH1A1LMNAKMT2AGAA
SCHEMBL842415 0.81 KMT2A (0.47) MAPTHTTALDH1A1MEN1KMT2A
SCHEMBL8870696 0.80 EGFR (0.47) MAPTHTTALDH1A1LMNAMEN1
SCHEMBL28560298 0.78 ALDH1A1 (0.45) MAPTHTTALDH1A1LMNAMEN1
SCHEMBL213367 0.78 CCNE2 (0.49) MAPTHTTALDH1A1LMNACCNE2
SCHEMBL211908 0.78 CCNE2 (0.49) MAPTHTTALDH1A1LMNACCNE2
SCHEMBL14950224 0.78 EGFR (0.47) MAPTHTTALDH1A1LMNAMEN1
SCHEMBL6106132 0.76 EGFR (0.43) MAPTHTTALDH1A1LMNAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1784180-A4 2-AMINO 1H IMIDAZO RING SYSTEMS AND METHODS 3M INNOVATIVE PROPERTIES CO (US) 2009-07-22 EP disclosed
EP-1948173-A2 HYDROXY AND ALKOXY SUBSTITUTED 1H-IMIDAZOQUINOLINES AND METHODS Coley Pharmaceutical Group, Inc. (US) 2008-07-30 EP disclosed
WO-2007056112-A2 HYDROXY AND ALKOXY SUBSTITUTED 1H-IMIDAZOQUINOLINES AND METHODS COLEY PHARMACEUTICAL GROUP, INC. (US) 2007-05-18 WO disclosed
EP-1784180-A2 2-AMINO 1H IMIDAZO RING SYSTEMS AND METHODS 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-05-16 EP disclosed
WO-2006029115-A2 2-AMINO 1H IMIDAZO RING SYSTEMS AND METHODS 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-03-16 WO disclosed