SCHEMBL8930344

SCHEMBL8930344

CC(=O)Oc1ccc(Cl)c(S(=O)(=O)O)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.51
POLB P06746 2/20 0.51
PKM P14618 1/20 0.51
KMT2A Q03164 2/20 0.49
CYP3A4 P08684 2/20 0.46
LMNA P02545 3/20 0.43
KDM4E B2RXH2 3/20 0.42
MEN1 O00255 1/20 0.42
TTR P02766 1/20 0.42
TP53 P04637 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ACHE P22303 2/20 0.41
CA2 P00918 6/20 0.41
CA12 O43570 1/20 0.40
GLA P06280 1/20 0.40
GAA P10253 1/20 0.40
CA9 Q16790 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
ABCB11 O95342 1/20 0.39
FLT3 P36888 1/20 0.39

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
SCHEMBL6488915 0.83 GSTO1 (0.51) MAPTPOLBPKMKMT2ACYP3A4
SCHEMBL29556983 0.81 KMT2A (0.61) MAPTPOLBPKMKMT2ACYP3A4
SCHEMBL343614 0.81 CYP3A4 (0.51) MAPTPOLBPKMKMT2ACYP3A4
SCHEMBL343567 0.81 KMT2A (0.61) MAPTPOLBPKMKMT2ACYP3A4
SCHEMBL18700972 0.81 PRKAB2 (0.48) MAPTPKMKMT2ATP53GAA
SCHEMBL344749 0.80 CYP3A4 (0.50) MAPTPOLBPKMKMT2ACYP3A4
SCHEMBL342726 0.80 KMT2A (0.59) MAPTPOLBPKMKMT2ACYP3A4
SCHEMBL8930369 0.80 MAPT (0.47) MAPTPOLBPKMKMT2ACYP3A4
Hydrochloric Acid SCHEMBL27854427 0.79 PRKAB2 (0.47) MAPTPKMKMT2ATP53GAA
SCHEMBL8930356 0.79 KMT2A (0.51) MAPTPOLBPKMKMT2ACYP3A4

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-5665150-A Dye and ink compositions XEROX CORPORATION (US) 1997-09-09 US disclosed