SCHEMBL28367406

SCHEMBL28367406

CCCCC(C)COC(=O)CC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.49
CYP3A4 P08684 1/20 0.49
ATM Q13315 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
NAAA Q02083 1/20 0.48
MAPT P10636 1/20 0.46
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
LMNA P02545 4/20 0.41
ALDH1A1 P00352 1/20 0.41
RECQL P46063 1/20 0.41
ACE2 Q9BYF1 1/20 0.40
KDM4E B2RXH2 1/20 0.40
DUSP3 P51452 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
FAAH O00519 2/20 0.38
PRKCA P17252 1/20 0.38
PRKCE Q02156 1/20 0.38
PRKCQ Q04759 1/20 0.38

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
SCHEMBL6295939 0.94 NAAA (0.52) TSHRCYP3A4ATMTDP1NAAA
SCHEMBL11585085 0.92 NAAA (0.55) NAAAMAPTLMNAALDH1A1ACE2
SCHEMBL27938986 0.92 NAAA (0.55) NAAAMAPTLMNAALDH1A1ACE2
SCHEMBL6790201 0.88 NAAA (0.42) TSHRCYP3A4ATMTDP1NAAA
SCHEMBL28465647 0.86 CYP3A4 (0.56) TSHRCYP3A4ATMTDP1MAPT
SCHEMBL3864189 0.86 CYP3A4 (0.66) TSHRCYP3A4ATMTDP1MAPT
SCHEMBL28223355 0.85 LMNA (0.41) TSHRCYP3A4ATMTDP1NAAA
SCHEMBL8576738 0.83 CA2 (0.44) TSHRCYP3A4ATMTDP1MAPT
SCHEMBL8646938 0.83 CA2 (0.44) TSHRCYP3A4ATMTDP1MAPT
SCHEMBL4625009 0.83 MAPT (0.69) TSHRCYP3A4ATMTDP1MAPT

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
CN-105899651-B Benefit agent containing delivery particles based on styrene maleic anhydride copolymers 宝洁公司 2020-02-07 CN claimed
CN-115919665-A Composition comprising a plurality of populations of microcapsules comprising perfume 宝洁公司 2023-04-07 CN disclosed
CN-105899651-B Benefit agent containing delivery particles based on styrene maleic anhydride copolymers 宝洁公司 2020-02-07 CN disclosed