SCHEMBL26028271

SCHEMBL26028271

N#Cc1cccc(S(=O)(=O)N2CCC3(CCC(N4CCOCC4)C3)CC2)c1F

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.39
TSHR P16473 1/20 0.39
PKM P14618 1/20 0.38
HSD11B1 P28845 2/20 0.37
CCR1 P32246 6/20 0.37
HDAC4 P56524 2/20 0.37
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37
HPGD P15428 1/20 0.36
ATM Q13315 2/20 0.36
LRRK2 Q5S007 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
RORC P51449 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL25363527 0.89 ATM (0.37) GAATSHRPKMHSD11B1CCR1
SCHEMBL30540005 0.89 ATM (0.37) GAATSHRPKMHSD11B1CCR1
SCHEMBL26029369 0.81 SMN1; SMN2 (0.44) GAATSHRHPGDATML3MBTL1
SCHEMBL30540014 0.79 KMT2A (0.36) TSHRCCR1HDAC4L3MBTL1
SCHEMBL25363210 0.79 KMT2A (0.36) TSHRCCR1HDAC4L3MBTL1
SCHEMBL26025706 0.78 HPGD (0.49) GAAHSD11B1HPGDATML3MBTL1
SCHEMBL26029337 0.78 TRPV4 (0.43) HSD11B1
SCHEMBL31554872 0.77 ATM (0.37) GAATSHRPKMHSD11B1CCR1
SCHEMBL26029381 0.77 ALDH1A1 (0.42) TSHRHPGDATM
SCHEMBL26025709 0.76 PKM (0.50) GAAPKML3MBTL1RORC

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-2023154499-A1 EMOPAMIL-BINDING PROTEIN INHIBITORS AND USES THEREOF BIOGEN MA INC. (US) 2023-08-17 WO disclosed