SCHEMBL28864332

SCHEMBL28864332

CN(C)c1ccccc1C(=O)c1cccc(C(=O)c2ccccc2)c1C(=O)c1ccccc1N(C)C

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.68
GAA P10253 2/20 0.68
SMN1; SMN2 Q16637 2/20 0.68
ALDH1A1 P00352 2/20 0.68
TSHR P16473 2/20 0.68
TP53 P04637 1/20 0.68
NPC1 O15118 1/20 0.46
HPGD P15428 1/20 0.46
RAB9A P51151 1/20 0.46
AKR1C3 P42330 2/20 0.46
CNR2 P34972 2/20 0.46
MYC P01106 1/20 0.46
POLB P06746 2/20 0.43
LMNA P02545 1/20 0.43
NFKB1 P19838 1/20 0.43
HTT P42858 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
KDM4E B2RXH2 1/20 0.41

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
SCHEMBL28351687 0.90 MAPT (0.78) MAPTGAASMN1; SMN2ALDH1A1TSHR
SCHEMBL29384309 0.90 MAPT (0.77) MAPTGAASMN1; SMN2ALDH1A1TSHR
SCHEMBL501813 0.90 MAPT (0.77) MAPTGAASMN1; SMN2ALDH1A1TSHR
SCHEMBL27496866 0.88 MAPT (0.58) MAPTGAASMN1; SMN2ALDH1A1TSHR
SCHEMBL30984650 0.88 MAPT (0.58) MAPTGAASMN1; SMN2ALDH1A1TSHR
Benzophenone SCHEMBL27403393 0.88 MAPT (0.74) MAPTGAASMN1; SMN2ALDH1A1TSHR
Urea SCHEMBL28233566 0.85 MAPT (0.69) MAPTGAASMN1; SMN2ALDH1A1TSHR
SCHEMBL338616 0.84 MAPT (0.80) MAPTGAASMN1; SMN2ALDH1A1TSHR
SCHEMBL29414304 0.84 MAPT (0.80) MAPTGAASMN1; SMN2ALDH1A1TSHR
SCHEMBL27564029 0.84 MAPT (0.53) MAPTGAASMN1; SMN2ALDH1A1TSHR

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
CN-110475829-B Ink composition, method for producing same, and image forming method 富士胶片株式会社 2022-09-20 CN disclosed