SCHEMBL8775148

SCHEMBL8775148

CCCCCC(C=C(C)C(N)=O)N(C)C

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LCK P06239 1/20 0.37
PPARD Q03181 1/20 0.37
ZDHHC20 Q5W0Z9 1/20 0.37
ZDHHC2 Q9UIJ5 1/20 0.37
GPR84 Q9NQS5 4/20 0.34
CA1 P00915 3/20 0.34
CA2 P00918 1/20 0.34
FFAR1 O14842 1/20 0.34
ZDHHC7 Q9NXF8 1/20 0.34
FAAH O00519 3/20 0.33
GRIK1 P39086 2/20 0.33
GRIK2 Q13002 2/20 0.33
SLC1A2 P43004 1/20 0.33
SLC1A1 P43005 1/20 0.33
MAPT P10636 1/20 0.33
TP53 P04637 1/20 0.33
LAP3 P28838 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
SCHEMBL11674043 0.98 LCK (0.40) LCKPPARDZDHHC20ZDHHC2GPR84
SCHEMBL8775422 0.95 CA2 (0.39) LCKPPARDZDHHC20ZDHHC2CA1
SCHEMBL3108908 0.88 CHRNB2 (0.31)
SCHEMBL28789066 0.83 LCK (0.44) LCKPPARDZDHHC20ZDHHC2GPR84
SCHEMBL18613642 0.83 LCK (0.44) LCKPPARDZDHHC20ZDHHC2GPR84
SCHEMBL7290715 0.80 TDP1 (0.31)
SCHEMBL33997 0.80 TDP1 (0.31)
SCHEMBL28931846 0.80 CA2 (0.38) LCKPPARDZDHHC20ZDHHC2CA1
Hydrochloric Acid SCHEMBL153917 0.79 TDP1 (0.31)
Bromide SCHEMBL3232025 0.79 TDP1 (0.31)

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 11 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
US-4020192-A AMINO ALKYL AMIDE ACRYLIC POLYMER FUJI XEROX CO., LTD. (JA) 1977-04-26 US claimed
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
US-5300288-A Acrylic amide polymers ROHM AND HAAS COMPANY (US) 1994-04-05 US disclosed
EP-0459632-A1 Composition and method for controlling cholesterol ROHM AND HAAS COMPANY (US) 1991-12-04 EP disclosed
US-4520210-A ALKYLATION IN WATER SOLUBLE KETONE THEN SEPARATION BASF AKTIENGESELLSCHAFT (DE) 1985-05-28 US disclosed
US-4020192-A AMINO ALKYL AMIDE ACRYLIC POLYMER FUJI XEROX CO., LTD. (JA) 1977-04-26 US disclosed