SCHEMBL8556615

SCHEMBL8556615

CC(C)(C)OC(=O)COc1cccc(C(=O)CN)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
BLM P54132 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
PSEN1 P49768 2/20 0.42
PSEN2 P49810 2/20 0.42
APH1B Q8WW43 2/20 0.42
NCSTN Q92542 2/20 0.42
APH1A Q96BI3 2/20 0.42
PSENEN Q9NZ42 2/20 0.42
PLA2G4B P0C869 1/20 0.41
KMT2A Q03164 5/20 0.40
ALDH1A1 P00352 2/20 0.40
NR4A1 P22736 1/20 0.40
NR4A2 P43354 1/20 0.40
NR4A3 Q92570 1/20 0.40
KDM4E B2RXH2 1/20 0.40
HTT P42858 1/20 0.40
MAPT P10636 2/20 0.40

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
SCHEMBL5047908 0.86 PARP1 (0.54) POLBPSEN1PSEN2APH1BNCSTN
SCHEMBL1928759 0.85 KMT2A (0.57) POLBNPC1RAB9APLA2G4BKMT2A
SCHEMBL499346 0.85 MAOB (0.55) SMN1; SMN2KMT2AMAPTMEN1
SCHEMBL17024452 0.84 LMNA (0.53) POLBPSEN1PSEN2APH1BNCSTN
SCHEMBL18038110 0.84 KMT2A (0.48) NPC1RAB9ASMN1; SMN2KMT2AALDH1A1
SCHEMBL3584866 0.83 PSEN1 (0.43) POLBPSEN1PSEN2APH1BNCSTN
SCHEMBL8558071 0.83 AOC3 (0.47) NPC1RAB9ASMN1; SMN2PSEN1PSEN2
SCHEMBL5353265 0.82 SMN1; SMN2 (0.53) POLBNPC1RAB9ABLMSMN1; SMN2
SCHEMBL22251779 0.82 HPGD (0.54) POLBPSEN1PSEN2APH1BNCSTN
SCHEMBL5046686 0.81 PPARA (0.46) POLBPSEN1PSEN2APH1BNCSTN

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
EP-0641770-B1 NOVEL COMPOUND WITH PLATELET AGGREGATION INHIBITOR ACTIVITY MEIJI SEIKA CO (JP) 1998-05-13 EP disclosed
US-5698692-A INHIBIT BINDING BETWEEN PLATELET MEMBRANE GLYCOPROTEIN AND FIBRINOGEN MEIJI SEIKA KABUSHIKI KAISHA (JP) 1997-12-16 US disclosed
US-5594004-A CARDIOVASCULAR DISORDERS AND ANTICOAGULANTS MEIJI SEIKA KABUSHIKI KAISHA (JP) 1997-01-14 US disclosed
EP-0641770-A1 NOVEL COMPOUND WITH PLATELET AGGREGATION INHIBITOR ACTIVITY MEIJI SEIKA KABUSHIKI KAISHA (JP) 1995-03-08 EP disclosed