SCHEMBL24943573

SCHEMBL24943573

CCCCNC(=O)c1ccc2c(c1)C(=O)OC21c2ccc(O)cc2Oc2cc(O)ccc21

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FTO Q9C0B1 9/20 0.57
▸ MEN1 O00255 1/20 0.55
▸ MAPT P10636 1/20 0.55
▸ HPGD P15428 1/20 0.55
▸ CYP2C19 P33261 1/20 0.55
▸ HTT P42858 1/20 0.55
▸ RECQL P46063 1/20 0.55
▸ BLM P54132 1/20 0.55
▸ SMAD3 P84022 1/20 0.55
▸ KMT2A Q03164 1/20 0.55
▸ PRMT1 Q99873 1/20 0.55
▸ ACE2 Q9BYF1 1/20 0.55
▸ TDP1 Q9NUW8 1/20 0.55
▸ ALB P02768 1/20 0.54
▸ JAK2 O60674 1/20 0.47
▸ KCNH2 Q12809 2/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ MMP14 P50281 1/20 0.46
▸ NAALAD2 Q9Y3Q0 1/20 0.45
▸ GSTP1 P09211 1/20 0.44

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
SCHEMBL17956704 0.95 FTO (0.60) FTOMEN1MAPTHPGDCYP2C19
SCHEMBL22100544 0.93 FTO (0.54) FTOMEN1MAPTHPGDCYP2C19
SCHEMBL19835756 0.90 FTO (0.53) FTOMEN1MAPTHPGDCYP2C19
SCHEMBL23599906 0.90 FTO (0.51) FTOMEN1MAPTHPGDCYP2C19
SCHEMBL24943524 0.89 ALB (0.56) FTOMEN1MAPTHPGDCYP2C19
SCHEMBL20353152 0.88 FTO (0.55) FTOMEN1MAPTHPGDCYP2C19
SCHEMBL22600489 0.88 KCNH2 (0.47) FTOMEN1MAPTHPGDCYP2C19
SCHEMBL16982918 0.88 FTO (0.60) FTOMEN1MAPTHPGDCYP2C19
SCHEMBL25138002 0.88 FTO (0.52) FTOMEN1MAPTHPGDCYP2C19
SCHEMBL917141 0.87 ALB (0.58) FTOMEN1MAPTHPGDCYP2C19

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
WO-2023006909-A1 FUNCTIONALISATION OF CARBOXYMETHYLCELLULOSE THE UNIVERSITY OF MANCHESTER (GB) 2023-02-02 — — WO disclosed
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