SCHEMBL7296176

SCHEMBL7296176

CCOC(=O)C(Cc1ccc(O)c(O)c1)NC(=O)OCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TYR P14679 2/20 0.55
EGFR P00533 1/20 0.54
CTSL P07711 5/20 0.53
CTSB P07858 4/20 0.53
CTSS P25774 4/20 0.53
CTSK P43235 3/20 0.52
ALDH1A1 P00352 1/20 0.51
ALOX15 P16050 1/20 0.51
TACR1 P25103 3/20 0.50
LCK P06239 1/20 0.50
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
ITGB3 P05106 1/20 0.49
ITGAV P06756 1/20 0.49

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
SCHEMBL27406872 1.00 TYR (0.55) TYREGFRCTSLCTSBCTSS
SCHEMBL5802843 0.93 TYR (0.62) TYRCTSLCTSBCTSSCTSK
SCHEMBL29559972 0.93 TYR (0.62) TYRCTSLCTSBCTSSCTSK
SCHEMBL7437357 0.93 TYR (0.62) TYRCTSLCTSBCTSSCTSK
SCHEMBL7323846 0.93 TYR (0.49) TYREGFRCTSLCTSBCTSS
SCHEMBL2947377 0.91 LCK (0.61) TYRCTSLCTSBCTSSCTSK
SCHEMBL9744805 0.88 TYR (0.58) TYRCTSLCTSBCTSSCTSK
SCHEMBL9744810 0.88 TYR (0.58) TYRCTSLCTSBCTSSCTSK
SCHEMBL30319896 0.88 TYR (0.58) TYRCTSLCTSBCTSSCTSK
SCHEMBL11199738 0.88 CTSL (0.62) TYRCTSLCTSBCTSSCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0393781-B1 Dopamine pro-drug ZAMBON SPA (IT) 1995-02-08 EP disclosed
EP-0607394-A1 DIPHOSPHATES OF CATECHOLAMINES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ZAMBON GROUP S.p.A. (IT) 1994-07-27 EP disclosed
WO-1994003461-A1 DIPHOSPHATES OF CATECHOLAMINES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ZAMBON GROUP S.P.A. (IT) 1994-02-17 WO disclosed
US-5073547-A DOPAMINE PRO-DRUG SIMES SOCIETA ITALIANA MEDICINALI E SINTETICI S.P.A. (IT) 1991-12-17 US disclosed
EP-0393781-A2 Dopamine pro-drug ZAMBON GROUP S.p.A. (IT) 1990-10-24 EP disclosed