SCHEMBL8775422

SCHEMBL8775422

CCCCC(C=C(C)C(N)=O)N(C)C

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.39
CA1 P00915 2/20 0.39
MAPK1 P28482 1/20 0.32
DPP7 Q9UHL4 7/20 0.32
DPP8 Q6V1X1 5/20 0.32
DPP4 P27487 5/20 0.32
DPP9 Q86TI2 5/20 0.32
SLC1A3 P43003 1/20 0.32
SLC1A2 P43004 1/20 0.32
SLC1A1 P43005 1/20 0.32
FAAH O00519 2/20 0.31
SLC15A1 P46059 1/20 0.31
LCK P06239 1/20 0.31
PPARD Q03181 1/20 0.31
ZDHHC20 Q5W0Z9 1/20 0.31
ZDHHC2 Q9UIJ5 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL8775148 0.95 LCK (0.37) CA2CA1SLC1A2SLC1A1FAAH
SCHEMBL11674043 0.93 LCK (0.40) CA2FAAHLCKPPARDZDHHC20
SCHEMBL3108908 0.89 CHRNB2 (0.31)
SCHEMBL28931846 0.85 CA2 (0.38) CA2CA1MAPK1DPP7DPP8
SCHEMBL33997 0.82 TDP1 (0.31)
SCHEMBL7290715 0.82 TDP1 (0.31)
Hydrochloric Acid SCHEMBL153917 0.80 TDP1 (0.31)
Bromide SCHEMBL3232025 0.80 TDP1 (0.31)
Acetic Acid SCHEMBL9818654 0.79
Chloromethane SCHEMBL21631052 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0606742-B1 Bile acid sequestrant ROHM & HAAS (US) 1997-11-19 EP claimed
US-5451397-A Crosslinked amino functional acrylic amide polymer, reducing blood cholesterol levels ROHM AND HAAS COMPANY (US) 1995-09-19 US claimed
EP-0606742-A1 Bile acid sequestrant ROHM AND HAAS COMPANY (US) 1994-07-20 EP claimed
CN-113943596-A Viscosity index improver and preparation method and application thereof 一汽解放汽车有限公司 2022-01-18 CN disclosed
CN-110894259-B Water-absorbent resin suitable for high-concentration brine and preparation method thereof 北部湾大学 2021-12-21 CN disclosed
CN-110894259-A Water-absorbent resin suitable for high-concentration brine and preparation method thereof 北部湾大学 2020-03-20 CN disclosed
EP-0606742-B1 Bile acid sequestrant ROHM & HAAS (US) 1997-11-19 EP disclosed
US-5451397-A Crosslinked amino functional acrylic amide polymer, reducing blood cholesterol levels ROHM AND HAAS COMPANY (US) 1995-09-19 US disclosed
EP-0606742-A1 Bile acid sequestrant ROHM AND HAAS COMPANY (US) 1994-07-20 EP disclosed