SCHEMBL7292923

SCHEMBL7292923

CC(C)OC(=O)[C@@H](N)Cc1ccc(OP(=O)(O)O)c(O)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 4/20 0.42
▸ LCK P06239 2/20 0.42
▸ ALOX12 P18054 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ USP2 O75604 1/20 0.42
▸ EGFR P00533 1/20 0.42
▸ FYN P06241 1/20 0.42
▸ ADORA3 P0DMS8 1/20 0.42
▸ PTGS1 P23219 1/20 0.42
▸ HTR2A P28223 1/20 0.42
▸ PTGS2 P35354 1/20 0.42
▸ RECQL P46063 1/20 0.42
▸ SLC7A5 Q01650 1/20 0.42
▸ HIF1A Q16665 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ GRB2 P62993 6/20 0.41
▸ NR1I2 O75469 1/20 0.40
▸ PPARG P37231 1/20 0.40
▸ AGTR2 P50052 1/20 0.40

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
SCHEMBL17685876 0.88 ALDH1A1 (0.52) ALOX15LCKALOX12KDM4EUSP2
SCHEMBL30946599 0.88 ALDH1A1 (0.52) ALOX15LCKALOX12KDM4EUSP2
SCHEMBL17685877 0.88 ALDH1A1 (0.52) ALOX15LCKALOX12KDM4EUSP2
SCHEMBL7295205 0.86 ALOX15 (0.43) ALOX15LCKALOX12KDM4EUSP2
SCHEMBL17693592 0.86 ALOX15 (0.47) ALOX15LCKALOX12KDM4EUSP2
SCHEMBL7292930 0.84 ALOX15 (0.44) ALOX15LCKALOX12KDM4EUSP2
SCHEMBL23069553 0.83 ALOX15 (0.47) ALOX15LCKALOX12KDM4EUSP2
Foslevodopa SCHEMBL17685899 0.83 SLC7A5 (0.61) ALOX15LCKKDM4EUSP2EGFR
Foslevodopa SCHEMBL17685900 0.83 SLC7A5 (0.61) ALOX15LCKKDM4EUSP2EGFR
SCHEMBL23069552 0.83 ALOX15 (0.47) ALOX15LCKALOX12KDM4EUSP2

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-0393781-B1 Dopamine pro-drug ZAMBON SPA (IT) 1995-02-08 — — EP 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
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