SCHEMBL25075398

SCHEMBL25075398

COCCCCNCCCCOC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.46
ALDH1A1 P00352 6/20 0.45
TSHR P16473 2/20 0.45
CYP2C19 P33261 4/20 0.43
CYP1A2 P05177 3/20 0.43
CYP2D6 P10635 1/20 0.42
MAPK1 P28482 1/20 0.42
PKM P14618 1/20 0.41
KMT2A Q03164 5/20 0.41
MEN1 O00255 4/20 0.41
GAA P10253 3/20 0.41
NPC1 O15118 1/20 0.41
LMNA P02545 1/20 0.41
CA12 O43570 1/20 0.38
F13A1 P00488 1/20 0.38
CA2 P00918 1/20 0.38
ALOX15 P16050 1/20 0.38
CA4 P22748 1/20 0.38
CA6 P23280 1/20 0.38
CA5A P35218 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
SCHEMBL7067353 0.97 KDM4E (0.44) KDM4EALDH1A1TSHRCYP2C19CYP1A2
SCHEMBL5932374 0.92 KDM4E (0.42) KDM4EALDH1A1TSHRCYP2C19CYP1A2
SCHEMBL4159314 0.90 MAPK1 (0.48) KDM4EALDH1A1TSHRCYP2C19CYP1A2
SCHEMBL24864839 0.89 ALDH1A1 (0.65) KDM4EALDH1A1TSHRCYP2C19CYP1A2
SCHEMBL11548639 0.87 EPHX1 (0.44) KDM4EALDH1A1TSHRCYP2C19CYP1A2
SCHEMBL19075314 0.87 ALDH1A1 (0.48) KDM4EALDH1A1TSHRCYP2C19CYP1A2
SCHEMBL22224038 0.87 ALDH1A1 (0.48) KDM4EALDH1A1TSHRCYP2C19CYP1A2
SCHEMBL5933722 0.86 MAPK1 (0.43) KDM4EALDH1A1TSHRCYP2C19CYP1A2
SCHEMBL1421256 0.86
SCHEMBL21367094 0.85 S1PR2 (0.39) KDM4EALDH1A1TSHRCYP2C19CYP1A2

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
WO-2023022926-A1 NANOPARTICLE COMPOSITIONS CONTAINING SUGAR FUNCTIONALIZED NUCLEIC ACID CARRIERS TIBA BIOTECH LLC (US) 2023-02-23 WO disclosed
CN-114466903-A Organosilicon-based products and their use 美国陶氏有机硅公司 2022-05-10 CN disclosed