SCHEMBL5564735

SCHEMBL5564735

Cc1nc2cc(C(=O)N(C)C)cc(O)c2n1C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 2/20 0.34
LRRK2 Q5S007 1/20 0.33
NAMPT P43490 1/20 0.33
NPC1 O15118 6/20 0.33
RAB9A P51151 6/20 0.33
ALPL P05186 3/20 0.33
ALPG P10696 3/20 0.33
MAPT P10636 3/20 0.33
ESRRA P11474 1/20 0.33
ALPP P05187 1/20 0.33
PLAA Q9Y263 1/20 0.33
POLB P06746 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
ERN1 O75460 1/20 0.32
ABL1 P00519 1/20 0.32
LMNA P02545 1/20 0.32
ATM Q13315 1/20 0.32

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
SCHEMBL1943217 0.79 PTGER4 (0.44) ALDH1A1NPC1RAB9AALPLALPG
SCHEMBL3555267 0.77 ALDH1A1 (0.34) KMT2AMEN1ALDH1A1NPC1RAB9A
SCHEMBL25647219 0.75 ALPL (0.36) KMT2AMEN1ALDH1A1NPC1RAB9A
SCHEMBL5564213 0.73 BRD4 (0.50) KMT2AALDH1A1LRRK2NPC1RAB9A
SCHEMBL5563949 0.72 ALDH1A1 (0.33) KMT2AMEN1ALDH1A1NAMPTNPC1
SCHEMBL16426895 0.71 ALDH1A1 (0.36) KMT2AMEN1ALDH1A1NPC1RAB9A
SCHEMBL21783726 0.69 POLB (0.39) KMT2AMEN1ALDH1A1LRRK2NPC1
SCHEMBL5656259 0.68 KDM4A (0.45) KMT2AMEN1ALDH1A1SMN1; SMN2LMNA
SCHEMBL1942259 0.68 PTGER4 (0.35) ALDH1A1NPC1RAB9AALPLALPG
SCHEMBL2119014 0.67 KDM4E (0.52) ALDH1A1ALPLALPGMAPTPOLB

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-1756067-A1 7-SUBSTITUTED BENZIMIDAZOLES AND THEIR USE AS INHIBITORS OF GASTRIC ACID SECRETION Altana Pharma AG (DE) 2007-02-28 EP disclosed
WO-2005111000-A1 7-SUBSTITUTED BENZIMIDAZOLES AND THEIR USE AS INHIBITORS OF GASTRIC ACID SECRETION ALTANA PHARMA AG (DE) 2005-11-24 WO disclosed