SCHEMBL24334334

SCHEMBL24334334

CCOc1ccc(F)cc1S(=O)(=O)NC(=O)c1cc2c(F)cc(N3CCC3)cc2o1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.41
MAPT P10636 3/20 0.41
TP53 P04637 1/20 0.40
ALPL P05186 5/20 0.38
KAT6A Q92794 2/20 0.36
MCHR1 Q99705 4/20 0.36
KCNH2 Q12809 3/20 0.36
TSHR P16473 1/20 0.35
MRGPRX1 Q96LB2 1/20 0.34
MEN1 O00255 2/20 0.34
HTT P42858 2/20 0.34
KMT2A Q03164 2/20 0.34
ERAP1 Q9NZ08 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HSD17B10 Q99714 1/20 0.34

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
SCHEMBL29469617 1.00 LMNA (0.41) LMNAMAPTTP53ALPLKAT6A
SCHEMBL24334319 0.93 TP53 (0.40) LMNAMAPTTP53KAT6AMCHR1
SCHEMBL29469680 0.93 TP53 (0.40) LMNAMAPTTP53KAT6AMCHR1
SCHEMBL29469701 0.92 TSHR (0.43) LMNAMAPTTP53ALPLKAT6A
SCHEMBL24333640 0.92 TSHR (0.43) LMNAMAPTTP53ALPLKAT6A
SCHEMBL24333954 0.92 TP53 (0.42) LMNAMAPTTP53KAT6AKCNH2
SCHEMBL24334414 0.92 LMNA (0.48) LMNAMAPTKAT6ATSHRMEN1
SCHEMBL24333774 0.91 ALDH1A1 (0.44) LMNAMAPTTP53ALPLTSHR
SCHEMBL24333735 0.91 TP53 (0.36) LMNAMAPTTP53KAT6AMEN1
SCHEMBL24334463 0.90 ALDH1A1 (0.37) LMNAMAPTTP53HTTERAP1

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-2022081807-A1 SUBSTITUTED ACYL SULFONAMIDES FOR TREATING CANCER THE BROAD INSTITUTE, INC. (US) 2022-04-21 WO disclosed