SCHEMBL5511254

SCHEMBL5511254

O=C(O)Nc1[nH]nc2c(Cl)nc3ccccc3c12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.38
KDM4E B2RXH2 3/20 0.38
GLA P06280 2/20 0.38
ALDH1A1 P00352 2/20 0.38
HPGD P15428 1/20 0.38
ATM Q13315 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HTT P42858 2/20 0.37
USP2 O75604 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
MAPT P10636 3/20 0.36
THRB P10828 1/20 0.36
NPY5R Q15761 2/20 0.36
AKR1B10 O60218 1/20 0.35
POLB P06746 1/20 0.35

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
SCHEMBL1898650 0.78 NOS1 (0.37) GAAKDM4EGLAALDH1A1HPGD
SCHEMBL14324206 0.77 CHEK1 (0.44) NOS1
SCHEMBL1894901 0.74 KMT2A (0.44) GAAKDM4EGLAALDH1A1HPGD
SCHEMBL14323570 0.71 PIM1 (0.41) KDM4EGLAALDH1A1SMN1; SMN2HTT
SCHEMBL14323875 0.70 ELANE (0.38) GAAKDM4EALDH1A1MAPTRAB9A
SCHEMBL1897854 0.67 ELANE (0.43) GAAKDM4EGLAALDH1A1HPGD
SCHEMBL6383953 0.63 HTT (0.49) GAAKDM4EALDH1A1HPGDATM
Bicarbonate SCHEMBL10870596 0.62 TDP1 (0.75) GAAKDM4EGLAALDH1A1HPGD
SCHEMBL730937 0.62 MAOA (0.44) KDM4EGLAALDH1A1HPGDSMN1; SMN2
SCHEMBL16541139 0.61 GPR3 (0.48) KDM4EALDH1A1HPGDCYP1A2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1869043-A2 PYRAZOLOPYRIDINE-1,4-DIAMINES AND ANALOGS THEREOF Coley Pharmaceutical Group, Inc. (US) 2007-12-26 EP disclosed
WO-2006107853-A2 PYRAZOLOPYRIDINE-1,4-DIAMINES AND ANALOGS THEREOF COLEY PHARMACEUTICAL GROUP, INC. (US) 2006-10-12 WO disclosed