SCHEMBL28883172

SCHEMBL28883172

CCCCC(CC)COC(N)=O.[Ag]

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.64
TSHR P16473 3/20 0.64
TDP1 Q9NUW8 3/20 0.64
ATM Q13315 1/20 0.64
ALDH1A1 P00352 7/20 0.55
CA2 P00918 4/20 0.55
RECQL P46063 1/20 0.53
LMNA P02545 3/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
MAPK1 P28482 3/20 0.49
HSD17B10 Q99714 1/20 0.49
PRSS1 P07477 1/20 0.49
PRSS2 P07478 1/20 0.49
PRSS3 P35030 1/20 0.49
CA1 P00915 1/20 0.46
MMP9 P14780 1/20 0.43
MMP8 P22894 1/20 0.43
MMP14 P50281 1/20 0.43

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
SCHEMBL467542 0.98 CYP3A4 (0.66) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL23878448 0.96 CYP3A4 (0.64) CYP3A4TSHRTDP1ATMALDH1A1
Ammonia Solution, Strong SCHEMBL23878442 0.96 CYP3A4 (0.64) CYP3A4TSHRTDP1ATMALDH1A1
Ether SCHEMBL9004316 0.91 CYP3A4 (0.58) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL1931920 0.91 ALDH1A1 (0.60) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL28912443 0.91 PRSS1 (0.59) CYP3A4TSHRTDP1ATMALDH1A1
Ether SCHEMBL9090340 0.87 CYP3A4 (0.54) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL24733682 0.86 CYP3A4 (0.50) CYP3A4TSHRTDP1ATMALDH1A1
Iodide SCHEMBL872505 0.85 CYP3A4 (0.49) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL10581132 0.84 CYP3A4 (0.49) 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-110769944-B Electromagnetic wave shielding coating method 印可得株式会社 2022-03-25 CN disclosed
CN-110769944-A Electromagnetic wave shielding coating method 印可得株式会社 2020-02-07 CN disclosed