SCHEMBL5572067

SCHEMBL5572067

CCCNC(=O)N1CC[CH]CC1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.54
NPSR1 Q6W5P4 1/20 0.49
HTT P42858 3/20 0.49
MEN1 O00255 3/20 0.48
CYP2C19 P33261 2/20 0.48
LMNA P02545 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
CYP2C9 P11712 1/20 0.44
CNR1 P21554 1/20 0.42
CNR2 P34972 1/20 0.42
POLB P06746 1/20 0.41
MAPK1 P28482 1/20 0.41
NAMPT P43490 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
SCHEMBL4555741 0.87 HTT (0.57) KMT2AHTTMEN1TDP1CNR1
SCHEMBL5238596 0.84 KMT2A (0.72) KMT2AHTTMEN1TDP1POLB
SCHEMBL24664428 0.82 KMT2A (0.59) KMT2ANPSR1HTTMEN1CYP2C19
SCHEMBL3705956 0.82 KMT2A (0.59) KMT2ANPSR1HTTMEN1CYP2C19
SCHEMBL4500837 0.80 KMT2A (0.41) KMT2AHTTCYP2C19TDP1MAPK1
SCHEMBL18170058 0.80 KMT2A (0.49) KMT2ANPSR1HTTMEN1CYP2C19
SCHEMBL1651682 0.80 LMNA (0.61) KMT2ANPSR1HTTMEN1CYP2C19
SCHEMBL10272740 0.78 TDP1 (0.62) KMT2ANPSR1HTTMEN1CYP2C19
Hydrochloric Acid SCHEMBL10806956 0.78 LMNA (0.59) KMT2ANPSR1HTTMEN1CYP2C19
SCHEMBL2760109 0.77 HTT (0.77) KMT2ANPSR1HTTMEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1863809-A2 PYRAZOLOPYRIDINES AND ANALOGS THEREOF Coley Pharmaceutical Group, Inc. (US) 2007-12-12 EP claimed
WO-2006107753-A2 PYRAZOLOPYRIDINES AND ANALOGS THEREOF COLEY PHARMACEUTICAL GROUP, INC. (US) 2006-10-12 WO claimed
EP-1863809-A2 PYRAZOLOPYRIDINES AND ANALOGS THEREOF Coley Pharmaceutical Group, Inc. (US) 2007-12-12 EP disclosed
WO-2006107753-A2 PYRAZOLOPYRIDINES AND ANALOGS THEREOF COLEY PHARMACEUTICAL GROUP, INC. (US) 2006-10-12 WO disclosed