SCHEMBL10787513

SCHEMBL10787513

N#Cc1cccc(C=Cc2ccc(-c3ccc(C=O)cc3)cc2)c1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ FBP1 P09467 3/20 0.53
▸ P4HB P07237 11/20 0.47
▸ MAOA P21397 2/20 0.42
▸ MAOB P27338 2/20 0.42
▸ HDAC2 Q92769 1/20 0.42
▸ GRIN2D O15399 2/20 0.41
▸ GRIN3B O60391 2/20 0.41
▸ GRIN1 Q05586 2/20 0.41
▸ GRIN2A Q12879 2/20 0.41
▸ GRIN2B Q13224 2/20 0.41
▸ GRIN2C Q14957 2/20 0.41
▸ GRIN3A Q8TCU5 2/20 0.41

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
SCHEMBL9190941 0.95 FBP1 (0.57) FBP1P4HBMAOAMAOBGRIN2D
SCHEMBL18002842 0.86 FBP1 (0.58) FBP1P4HBMAOAMAOBGRIN2D
SCHEMBL9186668 0.86 FBP1 (0.61) FBP1P4HBMAOAMAOBGRIN2D
SCHEMBL21574844 0.86 FBP1 (0.61) FBP1P4HBMAOAMAOBGRIN2D
SCHEMBL9186663 0.86 FBP1 (0.61) FBP1P4HBMAOAMAOBGRIN2D
SCHEMBL5849310 0.85 XDH (0.50) —
SCHEMBL21574806 0.83 FBP1 (0.57) FBP1P4HBMAOAMAOBGRIN2D
SCHEMBL9190221 0.83 FBP1 (0.57) FBP1P4HBMAOAMAOBGRIN2D
SCHEMBL1687907 0.83 FBP1 (0.57) FBP1P4HBMAOAMAOBGRIN2D
SCHEMBL10382303 0.83 HDAC2 (0.57) FBP1P4HBMAOBHDAC2

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
EP-0054511-B1 4-STYRYL-4'-VINYLBIFENYLS, METHODS FOR THEIR PREPARATION AND THEIR USE AS OPTICAL WHITENERS CIBA-GEIGY AG (CH) 1987-05-13 — — EP disclosed
US-4508784-A 4-Styryl-4'-vinylbiphenyls, the production thereof and use thereof as fluorescent CIBA GEIGY CORPORATION (US) 1985-04-02 — — US disclosed
EP-0054511-A2 4-Styryl-4'-vinylbifenyls, methods for their preparation and their use as optical whiteners CIBA-GEIGY AG (CH) 1982-06-23 — — EP disclosed
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