SCHEMBL8518202

SCHEMBL8518202

N#CCC(=O)Nc1ccc(O)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.65
CA1 P00915 2/20 0.65
CA2 P00918 2/20 0.65
CA9 Q16790 2/20 0.65
CYP1A2 P05177 1/20 0.55
CYP2C19 P33261 1/20 0.55
CYP1A1 P04798 2/20 0.55
ALDH1A1 P00352 5/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
PEPD P12955 1/20 0.48
BRD4 O60885 1/20 0.48
NR1I2 O75469 1/20 0.48
MB P02144 1/20 0.48
CA3 P07451 1/20 0.48
CYP3A4 P08684 1/20 0.48
MAPT P10636 1/20 0.48
RARG P13631 1/20 0.48
TSHR P16473 1/20 0.48
ALOX5AP P20292 1/20 0.48

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
SCHEMBL11122026 0.92 CA12 (0.73) CA12CA1CA2CA9CYP1A2
SCHEMBL1618221 0.83 ALDH1A1 (0.64) CA12CA1CA2CA9CYP1A2
SCHEMBL9206404 0.83 CA12 (0.63) CA12CA1CA2CA9CYP1A2
SCHEMBL1260228 0.83 CA12 (0.63) CA12CA1CA2CA9CYP1A2
SCHEMBL9819019 0.83 KMT2A (0.66) CA12CA1CA2CA9CYP1A2
SCHEMBL8626883 0.83 CA12 (0.63) CA12CA1CA2CA9CYP1A2
SCHEMBL9818903 0.83 CA12 (0.63) CA12CA1CA2CA9CYP1A2
SCHEMBL15651789 0.83 CA1 (0.68) CA12CA1CA2CA9CYP1A2
SCHEMBL6318825 0.83 POLB (0.66) CA12CA1CA2CA9CYP1A2
SCHEMBL1260216 0.82 SMN1; SMN2 (0.62) CA12CA1CA2CA9CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4304831-A ELECTROGRAPHY; COPIES RICOH CO., LTD. (JP) 1981-12-08 US claimed
US-5976753-A COPOLYMER EASTMAN KODAK COMPANY (US) 1999-11-02 US disclosed
US-5922822-A AN ACRYLATE COPOLYMER CHARGE-CONTROL AGENTS IN ELECTROSTATOGRAPHIC TONERS AND DEVELOPERS EASTMAN KODAK COMPANY (US) 1999-07-13 US disclosed
US-5849449-A Electrostatographic developer having toner particles containing polymers of (2-cyanoacetamido)phenyl acrylates polymers EASTMAN KODAK COMPANY (US) 1998-12-15 US disclosed
US-5750305-A Poly (2-(sulfonamidomethylene)-2-cyanoacetamido)phenyl acrylate! charge-control agents for electrostatographic toners and developers EASTMAN KODAK COMPANY (US) 1998-05-12 US disclosed
US-5739235-A CHARGE CONTROL AGENTS FOR ELECTROGRAPHY EASTMAN KODAK COMPANY (US) 1998-04-14 US disclosed
US-4304831-A ELECTROGRAPHY; COPIES RICOH CO., LTD. (JP) 1981-12-08 US disclosed