SCHEMBL6697450

SCHEMBL6697450

CC1COC(c2ccc(C3=NC(C)CO3)cc2)=N1.c1cc(C2=NCCO2)ccc1C1=NCCO1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
LTA4H P09960 1/20 0.37
MAPT P10636 3/20 0.36
ALDH1A1 P00352 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL12284463 0.88 NPC1 (0.50) MAPTNPC1RAB9A
SCHEMBL381475 0.86 MEN1 (0.46) MEN1KMT2AMAPTALDH1A1NPC1
SCHEMBL11254435 0.84 MAPT (0.34) MAPT
SCHEMBL132013 0.80 KCNH2 (0.49) KCNH2HRH3LTA4HSMN1; SMN2
SCHEMBL10519979 0.80 SMN1; SMN2 (0.43) KCNH2HRH3MEN1KMT2ALTA4H
SCHEMBL10524898 0.79 NPC1 (0.48) MAPTALDH1A1NPC1RAB9A
SCHEMBL12731994 0.79 MAPT (0.51) MEN1KMT2AMAPTALDH1A1NPC1
SCHEMBL7913803 0.77 ENPP2 (0.43) MEN1KMT2AMAPTALDH1A1NPC1
SCHEMBL7911822 0.77 ENPP2 (0.43) MEN1KMT2AMAPTALDH1A1NPC1
SCHEMBL7386839 0.77 MAPT (0.47) MEN1KMT2AMAPTALDH1A1NPC1

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
US-20040068059-A1 Aliphatic polyester copolymer and process for producing the same, biodegradable resin molding based on aliphatic polyester, and lactone-containing resin DAICEL CHEMICAL INDUSTRIES LTD. (JP) 2004-04-08 US disclosed
EP-1354908-A1 ALIPHATIC POLYESTER COPOLYMER AND PROCESS FOR PRODUCING THE SAME, BIODEGRADABLE RESIN MOLDING BASED ON ALIPHATIC POLYESTER, AND LACTONE-CONTAINING RESIN DAICEL CHEMICAL INDUSTRIES, Ltd. (JP) 2003-10-22 EP disclosed