SCHEMBL28964008

SCHEMBL28964008

CCCC(=O)OCC(C)CCCC([O])=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.45
CYP3A4 P08684 1/20 0.44
TSHR P16473 1/20 0.44
ATM Q13315 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
PTPN1 P18031 1/20 0.41
LMNA P02545 2/20 0.40
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 1/20 0.39
DUSP3 P51452 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
PRKCA P17252 3/20 0.37
PRKCE Q02156 1/20 0.37
PRKCQ Q04759 1/20 0.37
PRKCD Q05655 1/20 0.37
DGKA P23743 1/20 0.35
LPAR6 P43657 1/20 0.35
LPAR1 Q92633 1/20 0.35
LPAR4 Q99677 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
SCHEMBL28465647 0.87 CYP3A4 (0.56) MAPTCYP3A4TSHRATMTDP1
SCHEMBL28931197 0.87 CYP3A4 (0.41) MAPTCYP3A4TSHRATMTDP1
SCHEMBL29281683 0.85 MAPT (0.38) MAPTCYP3A4TSHRATMTDP1
SCHEMBL28323463 0.84 MAPT (0.59) MAPTCYP3A4TSHRATMTDP1
SCHEMBL9756867 0.81 MAPT (0.52) MAPTCYP3A4TSHRATMTDP1
SCHEMBL3864189 0.80 CYP3A4 (0.66) MAPTCYP3A4TSHRATMTDP1
SCHEMBL2342373 0.79 MAPT (0.66) MAPTCYP3A4TSHRATMTDP1
SCHEMBL2140711 0.79 MAPT (0.61) MAPTCYP3A4TSHRATMTDP1
SCHEMBL27297441 0.78 MAPT (0.59) MAPTCYP3A4TSHRATMTDP1
SCHEMBL28423604 0.77 MAPT (0.48) MAPTCYP3A4TSHRATMTDP1

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-112752802-B Acrylic coating composition containing inorganic oxide particles 日产化学株式会社 2023-03-03 CN disclosed