SCHEMBL8937850

SCHEMBL8937850

C=C(C#N)C(=O)c1cccc(O)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 2/20 0.50
▸ CA2 P00918 2/20 0.50
▸ CA9 Q16790 2/20 0.50
▸ CA1 P00915 1/20 0.50
▸ CA6 P23280 1/20 0.50
▸ PARP1 P09874 1/20 0.48
▸ KDM4E B2RXH2 4/20 0.46
▸ EGLN2 Q96KS0 1/20 0.46
▸ ALDH1A1 P00352 2/20 0.44
▸ FASN P49327 1/20 0.43
▸ P4HB P07237 1/20 0.42
▸ DYRK1A Q13627 2/20 0.42
▸ CLK1 P49759 1/20 0.42
▸ DYRK1B Q9Y463 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ STS P08842 1/20 0.40
▸ GAA P10253 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ MEN1 O00255 1/20 0.39

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
SCHEMBL2717259 0.79 CES2 (0.54) KDM4EALDH1A1MAPK1RAB9AMAPT
SCHEMBL3536565 0.78 CA12 (0.70) CA12CA2CA9CA1CA6
SCHEMBL22187989 0.77 CA12 (0.57) CA12CA2CA9CA1CA6
SCHEMBL5854006 0.76 CA12 (0.55) CA12CA2CA9CA1CA6
SCHEMBL23639661 0.73 CA12 (0.52) CA12CA2CA9CA1CA6
SCHEMBL3742481 0.72 CA12 (0.68) CA12CA2CA9CA1CA6
SCHEMBL9187064 0.72 CA12 (0.68) CA12CA2CA9CA1CA6
SCHEMBL7165837 0.71 CA12 (0.50) CA12CA2CA9CA1CA6
SCHEMBL9169773 0.71 NPSR1 (0.62) CA12CA2CA9CA1CA6
SCHEMBL7312813 0.71 CA12 (0.59) CA12CA2CA9CA1CA6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5556913-A CURABLE CATIONIC POLYMERS TO FORM FILMS NIPPON PAINT CO., LTD. (JP) 1996-09-17 — — US disclosed
EP-0431554-B1 Cationic electrocoating composition NIPPON PAINT CO LTD (JP) 1994-04-06 — — EP disclosed
EP-0431554-A2 Cationic electrocoating composition NIPPON PAINT CO., LTD. (JP) 1991-06-12 — — EP disclosed
Send feedback