SCHEMBL7429968

SCHEMBL7429968

CCOC(=O)OC1(CCCOCCc2ccc(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
ABCB11 O95342 1/20 0.43
MAPK1 P28482 1/20 0.43
ALDH1A1 P00352 3/20 0.35
CYP1A2 P05177 2/20 0.35
CYP3A4 P08684 2/20 0.35
CYP2C19 P33261 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
FKBP1A P62942 1/20 0.35
POLB P06746 3/20 0.35
SLC6A2 P23975 2/20 0.34
HRH1 P35367 2/20 0.34
HRH3 Q9Y5N1 2/20 0.34
CHRM2 P08172 2/20 0.34
ADRA2C P18825 1/20 0.34
SLC6A4 P31645 1/20 0.34
SLC6A3 Q01959 1/20 0.34
KCNH2 Q12809 1/20 0.34

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
SCHEMBL11022819 0.94 MAPT (0.45) MAPTLMNAABCB11MAPK1ALDH1A1
SCHEMBL11018171 0.92 MAPT (0.47) MAPTLMNAABCB11MAPK1ALDH1A1
SCHEMBL11202315 0.90 MAPT (0.45) MAPTLMNAABCB11MAPK1ALDH1A1
SCHEMBL7359104 0.87 MAPT (0.48) MAPTLMNAABCB11MAPK1ALDH1A1
SCHEMBL11208706 0.87 MAPT (0.48) MAPTLMNAABCB11MAPK1ALDH1A1
SCHEMBL7486243 0.85 ABCB11 (0.42) MAPTLMNAABCB11MAPK1KMT2A
SCHEMBL7485729 0.84 LMNA (0.39) MAPTLMNAABCB11MAPK1ALDH1A1
SCHEMBL11022009 0.84 LMNA (0.41) MAPTLMNAALDH1A1MEN1KMT2A
SCHEMBL7429080 0.83 MAPT (0.43) MAPTLMNAABCB11MAPK1ALDH1A1
SCHEMBL10876533 0.83 MAPT (0.40) MAPTLMNAABCB11MAPK1ALDH1A1

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 2 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
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