Methoxyacetic Acid

Methoxyacetic Acid

SCHEMBL9738426

COCC(=O)O.COc1ccc2c(c1)c(C)cn2Cc1ccc(Cl)cc1

nearest known ligand 0.55

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.55
ALDH1A1 P00352 3/20 0.55
HIF1A Q16665 3/20 0.55
PKM P14618 2/20 0.55
MEN1 O00255 2/20 0.55
CYP1A2 P05177 2/20 0.55
MAPT P10636 2/20 0.55
CYP2C9 P11712 2/20 0.55
PMP22 Q01453 2/20 0.55
KMT2A Q03164 2/20 0.55
RGS12 O14924 1/20 0.55
CYP3A4 P08684 1/20 0.55
TSHR P16473 1/20 0.55
NFKB1 P19838 1/20 0.55
MAPK1 P28482 1/20 0.55
CYP2C19 P33261 1/20 0.55
GNAI1 P63096 1/20 0.55
THRA P10827 7/20 0.55
THRB P10828 7/20 0.55
PLA2G2A P14555 3/20 0.51

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
SCHEMBL7696757 0.81 PLA2G2A (0.69) LMNAALDH1A1HIF1APKMMEN1
SCHEMBL16494825 0.80 HTR6 (0.64) LMNAALDH1A1KMT2ATSHRMAPK1
SCHEMBL3030239 0.79 MTNR1A (0.61) LMNAALDH1A1HIF1APKMMEN1
SCHEMBL11332785 0.77 MTNR1A (0.59) LMNAALDH1A1HIF1APKMMEN1
SCHEMBL12628559 0.76 LMNA (0.57) LMNAALDH1A1HIF1APKMMEN1
SCHEMBL13228557 0.76 LMNA (0.59) LMNAALDH1A1HIF1APKMMEN1
SCHEMBL20787916 0.75 CACNB4 (0.51) ALDH1A1MAPTTHRATHRBNPSR1
SCHEMBL12628346 0.75 BCHE (0.56) LMNAALDH1A1PLA2G2A
SCHEMBL13849520 0.74 LMNA (0.54) LMNAALDH1A1HIF1APKMMEN1
SCHEMBL8600343 0.74 SLC22A12 (0.67) LMNAALDH1A1HIF1APKMMEN1

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-0166591-B1 INDOLE-2-ALKANOIC ACIDS AND THEIR USE AS PROSTAGLANDIN ANTAGONISTS MERCK FROSST CANADA INC. (CA) 1989-11-23 EP claimed
EP-0166591-A2 Indole-2-alkanoic acids and their use as prostaglandin antagonists MERCK FROSST CANADA INC. (CA) 1986-01-02 EP claimed
US-5081145-A Contractile prostaglandin antagonists MERCK FROSST CANADA, INC. (CA) 1992-01-14 US disclosed
EP-0166591-B1 INDOLE-2-ALKANOIC ACIDS AND THEIR USE AS PROSTAGLANDIN ANTAGONISTS MERCK FROSST CANADA INC. (CA) 1989-11-23 EP disclosed
EP-0166591-A2 Indole-2-alkanoic acids and their use as prostaglandin antagonists MERCK FROSST CANADA INC. (CA) 1986-01-02 EP disclosed