SCHEMBL4783079

SCHEMBL4783079

O=C(O)c1ccc(CCNS(=O)(=O)c2cn(S(=O)(=O)c3ccccc3)c3cccc(C(F)(F)F)c23)cc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 8/20 0.45
MAPK1 P28482 1/20 0.42
KMT2A Q03164 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
HDAC2 Q92769 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
NR1H2 P55055 1/20 0.39
RORC P51449 1/20 0.38
SFRP1 Q8N474 1/20 0.38
PTGES O14684 1/20 0.38
USP2 O75604 1/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL4785325 0.87 TDP1 (0.51) MAPK1KMT2ATDP1ALDH1A1USP2
SCHEMBL4782630 0.83 KMT2A (0.48) AKR1C3MAPK1KMT2ATDP1ALDH1A1
SCHEMBL4782361 0.83 TBXAS1 (0.46) KMT2ATDP1
SCHEMBL4782672 0.81 ALDH1A1 (0.37) ALDH1A1PTGES
SCHEMBL4784743 0.81 HTR6 (0.41) ALDH1A1MAPT
SCHEMBL4783275 0.77 SMN1; SMN2 (0.49)
SCHEMBL4784746 0.77 LMNA (0.39) KMT2AMAPT
SCHEMBL4781750 0.77 SFRP1 (0.57) SFRP1
SCHEMBL4784750 0.76 NSD2 (0.46) AKR1C3ALDH1A1MAPTHDAC2HDAC8
SCHEMBL4785309 0.76 HTR6 (0.43) KMT2ATDP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008060998-A1 INDOLE SULFONAMIDES AS SFRP-1 MODULATORS WYETH (US) 2008-05-22 WO claimed
WO-2008060998-A1 INDOLE SULFONAMIDES AS SFRP-1 MODULATORS WYETH (US) 2008-05-22 WO disclosed
WO-2008060998-A1 INDOLE SULFONAMIDES AS SFRP-1 MODULATORS WYETH (US) 2008-05-22 WO disclosed