SCHEMBL17793731

SCHEMBL17793731

O=S(=O)(NCC(F)c1ccccc1)c1ccc(Cl)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.64
MEN1 O00255 6/20 0.64
KMT2A Q03164 6/20 0.64
LMNA P02545 3/20 0.64
NPSR1 Q6W5P4 2/20 0.64
SMN1; SMN2 Q16637 2/20 0.64
XBP1 P17861 1/20 0.64
CA1 P00915 1/20 0.63
CA2 P00918 1/20 0.63
ALDH1A1 P00352 4/20 0.61
GAA P10253 7/20 0.60
TP53 P04637 5/20 0.60
CYP1A2 P05177 1/20 0.57
CYP3A4 P08684 1/20 0.57
CYP2D6 P10635 1/20 0.57
CYP2C9 P11712 1/20 0.57
CYP2C19 P33261 1/20 0.57
ATM Q13315 1/20 0.57
GLA P06280 1/20 0.56
GBA1 P04062 1/20 0.53

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
SCHEMBL17793670 0.85 CA1 (0.64) MAPTMEN1KMT2ALMNANPSR1
SCHEMBL17793668 0.85 TP53 (0.58) MAPTMEN1KMT2ALMNANPSR1
SCHEMBL17793722 0.82 CA2 (0.56) MAPTMEN1KMT2ALMNANPSR1
SCHEMBL17793719 0.81 KMT2A (0.58) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL17793675 0.78 MAPT (0.63) MAPTMEN1KMT2ALMNANPSR1
SCHEMBL5502574 0.77 MAPT (0.59) MAPTMEN1KMT2ALMNANPSR1
SCHEMBL5146669 0.77 MEN1 (0.60) MAPTMEN1KMT2ALMNANPSR1
SCHEMBL5508771 0.77 MAPT (0.59) MAPTMEN1KMT2ALMNANPSR1
SCHEMBL17793667 0.76 GBA1 (0.61) MAPTMEN1KMT2ALMNANPSR1
SCHEMBL17793727 0.76 LMNA (0.51) MEN1KMT2ALMNASMN1; SMN2CA1

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-2016082052-A1 COMPOUNDS DERIVED FROM 2-PHENYL-2-FLUOROSULFONAMIDES, USED AS BUILDING BLOCKS IN ORGANIC SYNTHESIS, AND METHOD FOR THE PRODUCTION THEREOF PONTIFICIA UNIVERSIDAD CATOLICA DE CHILE (CL) 2016-06-02 WO disclosed