SCHEMBL7619956

SCHEMBL7619956

CCOC(O)n1cc(C=O)c2cccnc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.40
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
MEN1 O00255 2/20 0.40
KDM4E B2RXH2 1/20 0.40
HSP90AA1 P07900 1/20 0.40
IDO1 P14902 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ELANE P08246 7/20 0.39
ALDH1A1 P00352 4/20 0.38
ERN1 O75460 1/20 0.34
MAPT P10636 2/20 0.34
LMNA P02545 1/20 0.34
HPGD P15428 1/20 0.34
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
IMPDH2 P12268 1/20 0.33
SLC6A2 P23975 1/20 0.33
APP P05067 1/20 0.33

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
SCHEMBL7617430 0.79 ELANE (0.40) KMT2ANPC1RAB9AMEN1KDM4E
SCHEMBL6015972 0.76 APP (0.40) KMT2ANPC1RAB9AMEN1KDM4E
SCHEMBL31516345 0.71 CNR1 (0.44) KMT2ANPC1RAB9AMEN1KDM4E
SCHEMBL970742 0.71 ALDH1A1 (0.54) KMT2ANPC1RAB9AMEN1KDM4E
SCHEMBL4569764 0.70 KMT2A (0.45) KMT2ANPC1RAB9AMEN1KDM4E
SCHEMBL2491259 0.70 ELANE (0.59) KMT2ANPC1RAB9AMEN1KDM4E
SCHEMBL89569 0.69 GSK3B (0.53) NPC1RAB9AL3MBTL1ALDH1A1MAPT
SCHEMBL12670694 0.69 ELANE (0.52) NPC1RAB9AKDM4EELANEALDH1A1
SCHEMBL29277391 0.69 ALDH1A1 (0.51) KMT2ANPC1RAB9AKDM4EL3MBTL1
SCHEMBL413483 0.69 KMT2A (0.41) KMT2ANPC1RAB9AMEN1KDM4E

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-1181282-A2 BENZOTHIAZINONE AND BENZOXAZINONE COMPOUNDS BASF AKTIENGESELLSCHAFT (DE) 2002-02-27 EP disclosed
WO-2000075139-A2 BENZOTHIAZINONE AND BENZOXAZINONE COMPOUNDS BASF AKTIENGESELLSCHAFT (DE) 2000-12-14 WO disclosed