SCHEMBL9068592

SCHEMBL9068592

CCN1CC(O)CCCC1=O

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.36
BLM P54132 1/20 0.36
PIK3CD O00329 1/20 0.35
TSHR P16473 1/20 0.34
AKR1C3 P42330 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
GAA P10253 1/20 0.33

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
SCHEMBL24391279 0.89 APEX1 (0.38) APEX1BLMNPC1RAB9AGAA
SCHEMBL20555282 0.89 APEX1 (0.38) APEX1BLMNPC1RAB9AGAA
SCHEMBL9068590 0.86 L3MBTL1 (0.36) APEX1BLMNPC1RAB9A
SCHEMBL26947196 0.78 PIK3CD (0.35) PIK3CDTDP1
SCHEMBL30752552 0.76
SCHEMBL11523135 0.76
Ethylene Glycol SCHEMBL28125297 0.71 PIK3CD (0.52) APEX1PIK3CDTSHR
SCHEMBL15228231 0.71 PER2 (0.44) NPC1RAB9A
SCHEMBL14275822 0.69 TLR4 (0.31) NPC1RAB9A
SCHEMBL13472137 0.69 POLB (0.46) GAA

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8188299-B2 Acrylate derivatives, alcohol derivatives, and method for producing them KURARAY CO., LTD. (JP) 2012-05-29 US disclosed