SCHEMBL7303259

SCHEMBL7303259

N[C@@H](Cc1ccc(OP(=O)(O)O)c(O)c1)C(=O)OC1CCCCC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TYR P14679 1/20 0.45
▸ GRB2 P62993 6/20 0.40
▸ LCK P06239 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.38
▸ USP2 O75604 1/20 0.38
▸ EGFR P00533 1/20 0.38
▸ FYN P06241 1/20 0.38
▸ ADORA3 P0DMS8 1/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ PTGS1 P23219 1/20 0.38
▸ HTR2A P28223 1/20 0.38
▸ PTGS2 P35354 1/20 0.38
▸ RECQL P46063 1/20 0.38
▸ SLC7A5 Q01650 1/20 0.38
▸ HIF1A Q16665 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ SRC P12931 7/20 0.35
▸ YES1 P07947 1/20 0.35
▸ NR1I2 O75469 1/20 0.35

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
SCHEMBL7303263 0.85 TYR (0.47) TYRLCKKDM4EUSP2EGFR
SCHEMBL1070349 0.84 ALOX15 (0.55) TYRLCKKDM4EUSP2EGFR
Hydrochloric Acid SCHEMBL4187656 0.83 SLC7A5 (0.54) TYRLCKKDM4EUSP2EGFR
SCHEMBL17685877 0.80 ALDH1A1 (0.52) GRB2LCKKDM4EUSP2EGFR
SCHEMBL30946599 0.80 ALDH1A1 (0.52) GRB2LCKKDM4EUSP2EGFR
SCHEMBL17685876 0.80 ALDH1A1 (0.52) GRB2LCKKDM4EUSP2EGFR
SCHEMBL7295205 0.79 ALOX15 (0.43) GRB2LCKKDM4EUSP2EGFR
SCHEMBL23069553 0.79 ALOX15 (0.47) GRB2LCKKDM4EUSP2EGFR
Foslevodopa SCHEMBL17685900 0.79 SLC7A5 (0.61) LCKKDM4EUSP2EGFRFYN
SCHEMBL17693592 0.79 ALOX15 (0.47) GRB2LCKKDM4EUSP2EGFR

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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