SCHEMBL29469902

SCHEMBL29469902

CCOc1ccccc1S(=O)(=O)NC(=O)c1cc2c(F)cc(N3CCC3C)cc2o1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.37
ALDH1A1 P00352 4/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
HTT P42858 1/20 0.36
HSD17B10 Q99714 1/20 0.36
LMNA P02545 2/20 0.36
HPGD P15428 1/20 0.36
MAPT P10636 2/20 0.35
MAPK1 P28482 1/20 0.35
RORC P51449 2/20 0.35
TSHR P16473 1/20 0.34
ACHE P22303 2/20 0.34
GAA P10253 1/20 0.34
MRGPRX1 Q96LB2 3/20 0.34
HCRTR1 O43613 1/20 0.34
HCRTR2 O43614 1/20 0.34
MCHR1 Q99705 1/20 0.33
SSTR5 P35346 1/20 0.33
HRH1 P35367 1/20 0.33

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
SCHEMBL24333740 1.00 TP53 (0.37) TP53ALDH1A1MEN1KMT2AHTT
SCHEMBL29469629 0.91 ALDH1A1 (0.39) TP53ALDH1A1MEN1KMT2AHTT
SCHEMBL29469645 0.91 TP53 (0.36) TP53ALDH1A1MEN1KMT2AHTT
SCHEMBL24334384 0.91 ALDH1A1 (0.39) TP53ALDH1A1MEN1KMT2AHTT
SCHEMBL24334282 0.91 TP53 (0.36) TP53ALDH1A1MEN1KMT2AHTT
SCHEMBL24334385 0.91 ALDH1A1 (0.39) TP53ALDH1A1MEN1KMT2AHTT
SCHEMBL29469652 0.90 RORC (0.36) TP53ALDH1A1MEN1KMT2AHTT
SCHEMBL24333707 0.90 RORC (0.36) TP53ALDH1A1MEN1KMT2AHTT
SCHEMBL24334420 0.88 ALDH1A1 (0.36) TP53ALDH1A1MEN1KMT2AHTT
SCHEMBL29469703 0.88 ALDH1A1 (0.36) TP53ALDH1A1MEN1KMT2AHTT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4229048-A1 SUBSTITUTED ACYL SULFONAMIDES FOR TREATING CANCER The Broad Institute, Inc. (US) 2023-08-23 EP disclosed
WO-2022081807-A1 SUBSTITUTED ACYL SULFONAMIDES FOR TREATING CANCER THE BROAD INSTITUTE, INC. (US) 2022-04-21 WO disclosed