SCHEMBL8593147

SCHEMBL8593147

Cc1ccc2c(c1N)OCCC2=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
MAOB P27338 5/20 0.40
MAOA P21397 2/20 0.40
POLB P06746 1/20 0.39
NPC1 O15118 2/20 0.38
ALDH1A1 P00352 2/20 0.38
RAB9A P51151 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
CYP3A4 P08684 1/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
CASP3 P42574 1/20 0.38
HBB P68871 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
LTB4R Q15722 1/20 0.36
LTB4R2 Q9NPC1 1/20 0.36
GRM5 P41594 9/20 0.35

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
SCHEMBL7761381 0.82 TDP2 (0.44) LMNAMAPTMAOBMAOANPC1
SCHEMBL16404615 0.79 MAOB (0.40) LMNAMAPTMAOBMAOANPC1
SCHEMBL25166445 0.79 MAOB (0.40) LMNAMAPTMAOBMAOANPC1
SCHEMBL6937057 0.79 LMNA (0.60) LMNAMAPTMAOBMAOAALDH1A1
SCHEMBL19744350 0.75 MAPT (0.43) LMNAMAPTMAOBMAOAPOLB
SCHEMBL31170819 0.75 MAPT (0.43) LMNAMAPTMAOBMAOAPOLB
SCHEMBL8316043 0.74 LMNA (0.50) LMNAMAPTMAOBMAOAALDH1A1
SCHEMBL8592571 0.73 MAOB (0.36) LMNAMAPTMAOBMAOACYP3A4
SCHEMBL12316602 0.72 ESR1 (0.51) LMNAMAPTMAOBMAOAALDH1A1
SCHEMBL9404823 0.72 LMNA (0.65) LMNAMAPTMAOBMAOAALDH1A1

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-0546177-B1 BENZOPYRAN DERIVATIVE, PRODUCTION THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME TEIJIN LTD (JP) 1998-01-07 EP disclosed
US-5574061-A ANTILIPEMIC AGENT, ANTIATHEROSCLEROSIS, ACAT INHIBITOR TEIJIN LIMITED (JP) 1996-11-12 US disclosed
EP-0546177-A1 BENZOPYRAN DERIVATIVE, PRODUCTION THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME TEIJIN LIMITED (JP) 1993-06-16 EP disclosed