SCHEMBL19971462

SCHEMBL19971462

COc1ccc(-c2ccc3c(C(=O)O)cn(S(=O)(=O)c4cccnc4)c3c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.43
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
CHRNB4 P30926 1/20 0.42
CHRNA3 P32297 1/20 0.42
PIK3CG P48736 1/20 0.42
KEAP1 Q14145 4/20 0.42
NFE2L2 Q16236 4/20 0.42
HTR6 P50406 1/20 0.41
AKR1C3 P42330 1/20 0.41
AKR1C1 Q04828 1/20 0.41
CYP11B1 P15538 2/20 0.40
CYP11B2 P19099 2/20 0.40
ALDH1A1 P00352 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KCNQ1 P51787 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40

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
SCHEMBL16618555 0.91 KMT2A (0.52) LMNAKMT2AMEN1CHRNB4CHRNA3
SCHEMBL19971444 0.88 MEN1 (0.41) LMNAKMT2AMEN1PIK3CGAKR1C3
SCHEMBL19971365 0.83 AKR1C3 (0.42) LMNAKMT2AMEN1HTR6AKR1C3
SCHEMBL16618925 0.83 HTR6 (0.49) LMNACHRNB4CHRNA3KEAP1NFE2L2
SCHEMBL19971360 0.81 AKR1C3 (0.56) LMNAKMT2AMEN1HTR6AKR1C3
SCHEMBL16626627 0.81 HTR6 (0.46) LMNACHRNB4CHRNA3KEAP1NFE2L2
SCHEMBL19971359 0.80 HTR6 (0.42) LMNAKMT2AMEN1CHRNB4CHRNA3
Hydrochloric Acid SCHEMBL16619326 0.80 HTR6 (0.46) LMNACHRNB4CHRNA3KEAP1NFE2L2
SCHEMBL16619065 0.79 NR4A2 (0.49) KMT2AMEN1PIK3CGCYP11B1CYP11B2
SCHEMBL28068087 0.79 KMT2A (0.49) LMNAKMT2AMEN1CHRNB4CHRNA3

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
EP-3052484-B1 SULFONYLINDOLE DERIVATIVES AND METHOD FOR PREPARING THE SAME DAE WOONG PHARMA (KR) 2018-03-21 EP claimed