SCHEMBL7434385

SCHEMBL7434385

CN(c1ccccc1)c1c(N)[nH]c(=O)n(Cc2ccccc2)c1=O

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.50
HPGD P15428 5/20 0.50
CYP3A4 P08684 1/20 0.50
KDM4E B2RXH2 5/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.43
TLR7 Q9NYK1 3/20 0.42
RGS12 O14924 1/20 0.42
USP2 O75604 1/20 0.42
POLB P06746 1/20 0.42
MAPT P10636 1/20 0.42
PKM P14618 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
SCHEMBL7435188 0.80 GAA (0.52) ALDH1A1HPGDCYP3A4KDM4ESMN1; SMN2
SCHEMBL1945517 0.76 ALDH1A1 (0.57) ALDH1A1HPGDCYP3A4KDM4ESMN1; SMN2
SCHEMBL28178755 0.73 ALDH1A1 (0.53) ALDH1A1HPGDCYP3A4KDM4ESMN1; SMN2
SCHEMBL1946059 0.71 ALDH1A1 (0.51) ALDH1A1HPGDCYP3A4KDM4ESMN1; SMN2
SCHEMBL7434388 0.69 KDM4E (0.67) ALDH1A1HPGDCYP3A4KDM4ESMN1; SMN2
SCHEMBL7836791 0.67 HPGD (0.57) ALDH1A1HPGDCYP3A4KDM4ESMN1; SMN2
SCHEMBL1032784 0.67 HPGD (1.00) ALDH1A1HPGDCYP3A4KDM4ESMN1; SMN2
SCHEMBL7443811 0.67 G6PD (0.53) ALDH1A1HPGDCYP3A4KDM4ESMN1; SMN2
SCHEMBL7443806 0.67 G6PD (0.53) ALDH1A1HPGDCYP3A4KDM4ESMN1; SMN2
SCHEMBL5253014 0.66 HPGD (0.55) ALDH1A1HPGDCYP3A4KDM4ESMN1; SMN2

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
EP-0538332-B1 POLYCYCLIC GUANINE DERIVATIVES SCHERING CORP (US) 1997-07-23 EP disclosed
US-5393755-A Hypotensive agents, enzyme inhibitors SCHERING CORPORATION (US) 1995-02-28 US disclosed
WO-1991019717-A1 POLYCYCLIC GUANINE DERIVATIVES SCHERING CORPORATION (US) 1991-12-26 WO disclosed