SCHEMBL29288591

SCHEMBL29288591

CONS(=O)(=O)c1ccc(OC)c(OC)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.65
HTT P42858 2/20 0.65
SMN1; SMN2 Q16637 1/20 0.65
MAPK1 P28482 4/20 0.63
POLB P06746 1/20 0.63
TSHR P16473 1/20 0.63
PDE4A P27815 2/20 0.62
PDE4B Q07343 2/20 0.62
PDE4C Q08493 2/20 0.62
PDE4D Q08499 2/20 0.62
CA12 O43570 1/20 0.61
CA9 Q16790 1/20 0.61
FFAR4 Q5NUL3 1/20 0.59
KEAP1 Q14145 1/20 0.58
NFE2L2 Q16236 1/20 0.58
KMT2A Q03164 4/20 0.56
ALDH1A1 P00352 2/20 0.56
TP53 P04637 1/20 0.56
MEN1 O00255 3/20 0.55
ALOX15 P16050 1/20 0.54

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
SCHEMBL6927327 0.85 LMNA (0.69) LMNAHTTSMN1; SMN2MAPK1POLB
SCHEMBL4608475 0.83 LMNA (0.67) LMNAHTTSMN1; SMN2MAPK1POLB
SCHEMBL15880603 0.81 CA1 (0.73) LMNAHTTSMN1; SMN2MAPK1POLB
Hydrochloric Acid SCHEMBL4609744 0.81 LMNA (0.65) LMNAHTTSMN1; SMN2MAPK1POLB
SCHEMBL4182162 0.80 KMT2A (0.77) LMNAHTTSMN1; SMN2MAPK1POLB
SCHEMBL4608783 0.80 PDE4A (0.88) LMNAHTTSMN1; SMN2MAPK1POLB
SCHEMBL24040870 0.79 ALDH1A1 (0.74) LMNAHTTSMN1; SMN2MAPK1POLB
SCHEMBL4180372 0.79 KMT2A (0.61) LMNAHTTSMN1; SMN2MAPK1POLB
SCHEMBL12932731 0.79 SMN1; SMN2 (0.61) LMNAHTTSMN1; SMN2MAPK1POLB
SCHEMBL4609361 0.79 ALDH1A1 (0.74) LMNAHTTSMN1; SMN2MAPK1POLB

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-108610304-B Synthetic method of diaryl sultam compound 陕西师范大学 2021-10-15 CN disclosed