SCHEMBL7429080

SCHEMBL7429080

CCOC(=O)OC1(CCOCc2ccc(Cl)cc2)CO1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.43
LMNA P02545 2/20 0.43
MAPK1 P28482 2/20 0.43
ABCB11 O95342 1/20 0.43
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
NPSR1 Q6W5P4 2/20 0.38
ALDH1A1 P00352 4/20 0.37
CYP1A2 P05177 2/20 0.37
CYP3A4 P08684 2/20 0.37
CYP2C19 P33261 2/20 0.37
NPC1 O15118 1/20 0.36
TP53 P04637 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
GAA P10253 3/20 0.36
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 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
SCHEMBL11202315 0.83 MAPT (0.45) MAPTLMNAMAPK1ABCB11MEN1
SCHEMBL7429968 0.83 MAPT (0.43) MAPTLMNAMAPK1ABCB11MEN1
SCHEMBL11204901 0.82 POLB (0.43) MAPTLMNAMAPK1ABCB11MEN1
SCHEMBL11022819 0.82 MAPT (0.45) MAPTLMNAMAPK1ABCB11MEN1
SCHEMBL11018171 0.82 MAPT (0.47) MAPTLMNAMAPK1ABCB11MEN1
SCHEMBL11208706 0.81 MAPT (0.48) MAPTLMNAMAPK1ABCB11MEN1
SCHEMBL7359104 0.81 MAPT (0.48) MAPTLMNAMAPK1ABCB11MEN1
SCHEMBL7428632 0.81 NAAA (0.39) MAPTLMNAMAPK1ALDH1A1CYP3A4
SCHEMBL11290491 0.81 MAPT (0.62) MAPTLMNAMAPK1ABCB11MEN1
SCHEMBL6262992 0.78 MAPT (0.68) MAPTLMNAMAPK1ABCB11MEN1

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-0046590-B1 PHEN(ALK)OXY-SUBSTITUTED OXIRANE-CARBOXYLIC ACIDS, PROCESS FOR THEIR PREPARATION, THEIR USE AND DRUGS CONTAINING THEM Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1985-05-22 EP disclosed
WO-1982000643-A1 SUBSTITUTED OXIRANECARBONIC ACIDS,PREPARATION AND PHARMACEUTICAL UTILISATION THEREOF BYK GULDEN LOMBERG CHEM FAB (DE) 1982-03-04 WO disclosed
EP-0046590-A2 Phen(alk)oxy-substituted oxirane-carboxylic acids, process for their preparation, their use and drugs containing them Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1982-03-03 EP disclosed