SCHEMBL28097053

SCHEMBL28097053

CC(C)(C)NC(=O)OCC1CCC(O)CC1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.36
ACACB O00763 1/20 0.36
ACACA Q13085 1/20 0.36
PTGIR P43119 1/20 0.35
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
ATM Q13315 1/20 0.35
CYP3A4 P08684 2/20 0.33
KDM4E B2RXH2 1/20 0.33
HDAC3 O15379 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
GBA1 P04062 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
NR1H4 Q96RI1 1/20 0.32
LMNA P02545 1/20 0.31
NPC1 O15118 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TSHR P16473 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
SCHEMBL25518973 0.93 CNR2 (0.40) CNR2ACACBACACAPTGIRMEN1
SCHEMBL17444434 0.86 CNR2 (0.36) CNR2ACACBACACAPTGIRMEN1
SCHEMBL17444433 0.86 CNR2 (0.36) CNR2ACACBACACAPTGIRMEN1
SCHEMBL25284961 0.86 MEN1 (0.42) CNR2ACACBACACAPTGIRMEN1
SCHEMBL19267841 0.86 MEN1 (0.46) CNR2ACACBACACAMEN1MAPT
SCHEMBL27593051 0.85 PLG (0.39) CNR2ACACBACACAPTGIRMEN1
SCHEMBL27593235 0.85 CNR2 (0.36) CNR2ACACBACACAPTGIRMEN1
SCHEMBL3603129 0.84 GBA1 (0.33) ACACBACACAMEN1MAPTKMT2A
SCHEMBL28255026 0.84 MEN1 (0.48) MEN1MAPTKMT2AATMHDAC3
SCHEMBL27691300 0.83 CNR2 (0.35) CNR2ACACBACACAPTGIRMEN1

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
CN-110358120-A A kind of preparation method and product of ultra-thin ultralow shrinking percentage graphene polyimides heat conducting film 江苏亚宝绝缘材料股份有限公司 2019-10-22 CN claimed
CN-110358120-A A kind of preparation method and product of ultra-thin ultralow shrinking percentage graphene polyimides heat conducting film 江苏亚宝绝缘材料股份有限公司 2019-10-22 CN disclosed
CN-110358120-A A kind of preparation method and product of ultra-thin ultralow shrinking percentage graphene polyimides heat conducting film 江苏亚宝绝缘材料股份有限公司 2019-10-22 CN disclosed
CN-105916499-A 12-epi-pleuromutilins 纳布里瓦治疗股份公司 2016-08-31 CN disclosed