SCHEMBL8105477

SCHEMBL8105477

CC(=O)CCOC1CCCCO1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
KDM4C Q9H3R0 1/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.35
CREBBP Q92793 2/20 0.33
EP300 Q09472 1/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
ADORA3 P0DMS8 1/20 0.32
ALDH1A1 P00352 1/20 0.31
GCK P35557 1/20 0.31

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
SCHEMBL6879144 0.90 MEN1 (0.52) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL10344454 0.90 MEN1 (0.52) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL10344379 0.89 MEN1 (0.54) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL14138278 0.89 MEN1 (0.54) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL9316469 0.89 MEN1 (0.54) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL27200218 0.89 MEN1 (0.54) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL11552723 0.87 MEN1 (0.47) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL26695813 0.85 KMT2A (0.47) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL11550525 0.85 MEN1 (0.48) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL3280049 0.84 MEN1 (0.49) MEN1KMT2AKDM4CNPC1RAB9A

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
CN-101041650-B Synthesizing of 3,5-dihydroxy-3-methyl valerolactone XUZHOU RUISAI TECHNOLOGY INDUSTRY CO LTD 2010-10-13 CN disclosed
CN-101041650-A Synthesizing of 3,5-dihydroxy-3-methyl valerolactone XUZHOU RUISAI TECHNOLOGY INDUS (CN) 2007-09-26 CN disclosed
JP-2000290274-A NEW SYNTHESIS METHOD OF D,L-MEVALONOLACTONE CHEMICAL SOFT KAIHATSU KENKYUSHO:KK 2000-10-17 JP disclosed