SCHEMBL4036371

SCHEMBL4036371

COc1ncccc1-c1cc(Cl)c2cccnc2c1O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.57
MEN1 O00255 4/20 0.57
HTT P42858 4/20 0.57
SMN1; SMN2 Q16637 4/20 0.57
KDM4E B2RXH2 4/20 0.57
LMNA P02545 4/20 0.57
MAPT P10636 4/20 0.57
MMP14 P50281 3/20 0.57
TDP1 Q9NUW8 3/20 0.57
ALOX12 P18054 3/20 0.57
HSP90AA1 P07900 3/20 0.57
TP53 P04637 3/20 0.57
ALDH1A1 P00352 2/20 0.57
CYP3A4 P08684 2/20 0.57
ALOX15 P16050 2/20 0.57
SLC6A2 P23975 2/20 0.57
OPRK1 P41145 2/20 0.57
ALOX15B O15296 1/20 0.57
NR1I2 O75469 1/20 0.57
HTR1A P08908 1/20 0.57

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
SCHEMBL4034449 0.87 NPC1 (0.52) KMT2AMEN1HTTSMN1; SMN2KDM4E
SCHEMBL6051170 0.85 KDM4E (0.77) KMT2AMEN1HTTSMN1; SMN2KDM4E
SCHEMBL8345688 0.81 HSP90AA1 (0.60) KMT2AMEN1HTTSMN1; SMN2KDM4E
SCHEMBL4040116 0.80 KDM4E (0.64) KMT2AMEN1HTTSMN1; SMN2KDM4E
SCHEMBL8344674 0.80 KDM4E (0.56) KMT2AMEN1HTTSMN1; SMN2KDM4E
SCHEMBL4044274 0.80 L3MBTL1 (0.43) KMT2AMEN1HTTSMN1; SMN2KDM4E
SCHEMBL8344672 0.78 TP53 (0.54) KMT2AMEN1HTTSMN1; SMN2KDM4E
SCHEMBL8345105 0.78 KDM4E (0.60) KMT2AMEN1HTTSMN1; SMN2KDM4E
SCHEMBL18586710 0.76 ALDH1A1 (0.47) SMN1; SMN2KDM4EMAPTALDH1A1L3MBTL1
SCHEMBL29587886 0.76 ALDH1A1 (0.47) SMN1; SMN2KDM4EMAPTALDH1A1L3MBTL1

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
CN-101611009-A Quinoline derivatives CHRONOGEN INC (US) 2009-12-23 CN claimed
CN-101611009-A Quinoline derivatives CHRONOGEN INC (US) 2009-12-23 CN disclosed
EP-2079699-A1 QUINOLINE DERIVATIVES Envivo Pharmaceuticals, Inc. (US) 2009-07-22 EP disclosed
WO-2008014602-A1 QUINOLINE DERIVATIVES ENVIVO PHARMACEUTICALS, INC. (US) 2008-02-07 WO disclosed