SCHEMBL29601869

SCHEMBL29601869

Cc1ccc(C(NCCCCCC(N)=O)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 6/20 0.45
HDAC3 O15379 4/20 0.42
HDAC1 Q13547 4/20 0.42
HDAC2 Q92769 2/20 0.42
HDAC8 Q9BY41 1/20 0.42
NCOR2 Q9Y618 1/20 0.42
LMNA P02545 2/20 0.41
POLB P06746 1/20 0.41
ALDH1A1 P00352 1/20 0.41
KCNN4 O15554 1/20 0.40
HDAC6 Q9UBN7 3/20 0.40
RAB9A P51151 1/20 0.39
HDAC10 Q969S8 1/20 0.39
L3MBTL1 Q9Y468 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
SCHEMBL30625928 0.85 KIF11 (0.56) KIF11KCNN4L3MBTL1
SCHEMBL29634957 0.82 KIF11 (0.49) KIF11LMNAPOLB
SCHEMBL29562983 0.81 KIF11 (0.47) KIF11LMNAPOLBALDH1A1KCNN4
SCHEMBL3607590 0.81 TBXA2R (0.51) KIF11HDAC3HDAC1HDAC2HDAC8
SCHEMBL6751139 0.80 KIF11 (0.58) KIF11HDAC3HDAC1HDAC2HDAC8
SCHEMBL2238290 0.80 KIF11 (0.60) KIF11
SCHEMBL1268931 0.80 KIF11 (0.60) KIF11
SCHEMBL30148489 0.80 KIF11 (0.60) KIF11
SCHEMBL7168986 0.79 KIF11 (0.52) KIF11HDAC3HDAC1HDAC2HDAC8
SCHEMBL29649596 0.79 ALDH1A1 (0.51) HDAC3HDAC1HDAC2HDAC8NCOR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116669773-A Method for functionalizing nanoparticles 易达制药公司 2023-08-29 CN disclosed
CN-116568335-A Folate receptor targeted nanoparticle drug conjugate and application thereof 易达制药公司 2023-08-08 CN disclosed
EP-4106820-A1 METHODS OF FUNCTIONALIZING NANOPARTICLES Elucida Oncology, Inc. (US) 2022-12-28 EP disclosed
WO-2022093794-A9 METHODS OF FUNCTIONALIZING NANOPARTICLES ELUCIDA ONCOLOGY, INC. (US) 2022-06-09 WO disclosed
WO-2022093794-A1 METHODS OF FUNCTIONALIZING NANOPARTICLES ELUCIDA ONCOLOGY, INC. (US) 2022-05-05 WO disclosed