SCHEMBL29777945

SCHEMBL29777945

CCCCC(CC)COC(=O)OOO

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.60
TSHR P16473 3/20 0.60
TDP1 Q9NUW8 2/20 0.60
ATM Q13315 1/20 0.60
ALDH1A1 P00352 6/20 0.53
CA2 P00918 5/20 0.53
RECQL P46063 1/20 0.50
LMNA P02545 3/20 0.48
L3MBTL1 Q9Y468 1/20 0.47
MAPK1 P28482 3/20 0.47
HSD17B10 Q99714 1/20 0.47
PRSS1 P07477 1/20 0.47
PRSS2 P07478 1/20 0.47
PRSS3 P35030 1/20 0.47
MMP9 P14780 1/20 0.41
MMP8 P22894 1/20 0.41
MMP14 P50281 1/20 0.41
CA1 P00915 2/20 0.41

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
SCHEMBL35431 0.91 CYP3A4 (0.66) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL93541 0.88 CYP3A4 (0.62) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL94797 0.87 CYP3A4 (0.70) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL11765553 0.86 CYP3A4 (0.60) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL584511 0.86 CYP3A4 (0.60) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL1501810 0.86 CYP3A4 (0.60) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL929046 0.86 CYP3A4 (0.64) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL27748798 0.86 CYP3A4 (0.64) CYP3A4TSHRTDP1ATMALDH1A1
Water SCHEMBL6315641 0.85 CYP3A4 (0.68) CYP3A4TSHRTDP1ATMALDH1A1
Hydrogen Peroxide SCHEMBL28532747 0.85 CYP3A4 (0.68) CYP3A4TSHRTDP1ATMALDH1A1

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
CN-115044322-A Packaging adhesive film for HJT and preparation method thereof 浙江帝龙光电材料有限公司 2022-09-13 CN disclosed
CN-114921187-A Packaging adhesive film and preparation method and application thereof 苏州赛伍应用技术股份有限公司 2022-08-19 CN disclosed