SCHEMBL28336789

SCHEMBL28336789

CC(C(O)O)C(O)COC(=O)CCCCC(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.49
LMNA P02545 4/20 0.42
KDM4E B2RXH2 1/20 0.42
DUSP3 P51452 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
TSHR P16473 3/20 0.41
ALDH1A1 P00352 1/20 0.40
CYP3A4 P08684 1/20 0.40
ATM Q13315 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
PAM P19021 2/20 0.40
LPAR6 P43657 1/20 0.38
LPAR1 Q92633 1/20 0.38
LPAR4 Q99677 1/20 0.38
LPAR5 Q9H1C0 1/20 0.38
LPAR2 Q9HBW0 1/20 0.38
LPAR3 Q9UBY5 1/20 0.38
ENPP2 Q13822 1/20 0.38
PRKCA P17252 1/20 0.37

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
SCHEMBL3140885 0.84 MAPT (0.54) MAPTLMNAKDM4EDUSP3MEN1
SCHEMBL605904 0.82 MAPT (0.70) MAPTLMNAKDM4EDUSP3MEN1
SCHEMBL15171991 0.82 MAPT (0.46) MAPTLMNAKDM4EDUSP3MEN1
SCHEMBL1165277 0.80 MAPT (0.73) MAPTLMNAKDM4EDUSP3MEN1
SCHEMBL7115976 0.80 MAPT (0.73) MAPTLMNAKDM4EDUSP3MEN1
SCHEMBL536470 0.80 MAPT (0.52) MAPTLMNAKDM4EDUSP3MEN1
SCHEMBL409033 0.80 MAPT (0.52) MAPTLMNAKDM4EDUSP3MEN1
SCHEMBL10893020 0.78 MAPT (0.65) MAPTLMNAKDM4EDUSP3MEN1
SCHEMBL5487490 0.78 MAPT (0.55) MAPTLMNAKDM4EDUSP3MEN1
SCHEMBL27216258 0.78 MAPT (0.55) MAPTLMNAKDM4EDUSP3MEN1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110551270-A Aqueous polyurethane dispersion and preparation method and application thereof BEIJING COMENS NEW MAT CO LTD 2019-12-10 CN disclosed