SCHEMBL8375156

SCHEMBL8375156

O=S(=O)(Nc1ccc(Cl)nc1)c1c(F)c(F)c(F)c(F)c1F.O=S(=O)(Nc1ccc(OC(F)(F)F)cc1)c1c(F)c(F)c(F)c(F)c1F

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.47
ALDH1A1 P00352 1/20 0.47
MAPK1 P28482 1/20 0.47
CCR9 P51686 1/20 0.45
KIF11 P52732 1/20 0.44
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
MEN1 O00255 1/20 0.42
GALK1 P51570 1/20 0.42
KMT2A Q03164 1/20 0.42
ATM Q13315 1/20 0.41
IDH1 O75874 1/20 0.41
TP53 P04637 2/20 0.40
PKM P14618 1/20 0.40
KDM4E B2RXH2 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
KCNJ11 Q14654 1/20 0.40

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
SCHEMBL6086516 0.86 CA1 (0.51) CA1CA2MEN1KMT2AKDM4E
SCHEMBL6088751 0.86 KIF11 (0.56) SMN1; SMN2ALDH1A1MAPK1KIF11CA1
SCHEMBL6087435 0.74 CA1 (0.54) SMN1; SMN2ALDH1A1MAPK1KIF11CA1
SCHEMBL6673886 0.71 ALDH1A1 (0.51) SMN1; SMN2ALDH1A1MAPK1KIF11CA1
SCHEMBL7570513 0.71 FFAR4 (0.64) SMN1; SMN2ALDH1A1MAPK1KIF11CA1
SCHEMBL9517004 0.70 TP53 (0.57) SMN1; SMN2ALDH1A1MAPK1KIF11MEN1
SCHEMBL7570765 0.70 CES1 (0.67) SMN1; SMN2ALDH1A1IDH1TP53HDAC1
SCHEMBL23674890 0.70 KIF11 (0.65) SMN1; SMN2ALDH1A1MAPK1KIF11KMT2A
SCHEMBL6086454 0.70 CA1 (0.64) ALDH1A1KIF11CA1CA2
SCHEMBL20847671 0.69 CA1 (0.68) ALDH1A1MAPK1CA1CA2MEN1

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
US-5880151-A TREATING OR PREVENTING DISEASE CHARACTERIZED BY HIGH LEVELS OF LOW DENSITY LIPOPROTEIN PARTICLES OR CHOLESTEROL IN BLOOD TULARIK INC. (US) 1999-03-09 US claimed