SCHEMBL27675472

SCHEMBL27675472

C#CCOC(Cl)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
HTR2A P28223 2/20 0.38
HRH1 P35367 2/20 0.38
TDP1 Q9NUW8 1/20 0.36
NPC1 O15118 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
CYP1A2 P05177 4/20 0.35
CYP2D6 P10635 3/20 0.35
LMNA P02545 2/20 0.35
KCNH2 Q12809 2/20 0.35
ADRA2A P08913 2/20 0.35
ADRA2B P18089 2/20 0.35
ADRA1A P35348 2/20 0.35
OPRK1 P41145 2/20 0.35
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35
CHRM5 P08912 1/20 0.35
CHRM1 P11229 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
SCHEMBL77607 0.82 TSHR (0.39) TSHRTDP1NPC1SMN1; SMN2CYP1A2
SCHEMBL9808521 0.80 TSHR (0.39) TSHRMEN1KMT2AHTR2AHRH1
SCHEMBL6455092 0.79 NPC1 (0.38) TSHRMEN1KMT2AHTR2AHRH1
SCHEMBL17288627 0.79 MEN1 (0.51) TSHRMEN1KMT2AHTR2AHRH1
SCHEMBL27811270 0.76 MEN1 (0.38) TSHRMEN1KMT2AHTR2AHRH1
SCHEMBL27811527 0.76 TRPA1 (0.38) TSHRMEN1KMT2AHTR2AHRH1
SCHEMBL10346414 0.76 CYP1A2 (0.38) TSHRMEN1KMT2AHTR2AHRH1
SCHEMBL8749377 0.76 NPC1 (0.40) TSHRMEN1KMT2ANPC1CYP1A2
SCHEMBL6131994 0.76 MEN1 (0.41) TSHRMEN1KMT2AHTR2AHRH1
SCHEMBL11247443 0.74 TSHR (0.46) TSHRHTR2AHRH1TDP1SMN1; SMN2

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-111848975-B Phosphorylated protein, intracellular delivery system based on phosphorylated protein, preparation method and application 苏州大学 2022-07-19 CN disclosed
CN-111848975-A Phosphorylated protein, intracellular delivery system based on phosphorylated protein, preparation method and application 苏州大学 2020-10-30 CN disclosed
CN-101006119-A Click chemistry pathways for triazole dendrimers SCRIPPS RESEARCH INST (US) 2007-07-25 CN disclosed