SCHEMBL11812908

SCHEMBL11812908

CCCOC1Oc2ccc(CCCNS(=O)(=O)O)cc2C1(C)C

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
MAPT P10636 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
KCNE1 P15382 2/20 0.30
KCNQ1 P51787 2/20 0.30
KCNA5 P22460 1/20 0.30

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
SCHEMBL11809992 0.94 KCNA5 (0.34) MEN1KMT2AKCNE1KCNQ1KCNA5
SCHEMBL11813249 0.92 MEN1 (0.32) MEN1KMT2A
SCHEMBL11813201 0.87 LMNA (0.33) MAPTMEN1KMT2AKCNE1KCNQ1
SCHEMBL11802554 0.87 POLB (0.32) MEN1KMT2A
SCHEMBL11811221 0.86
SCHEMBL11809296 0.85 SMN1; SMN2 (0.35) MAPTMEN1KMT2AKCNA5
SCHEMBL11810724 0.84 ALDH1A1 (0.31)
SCHEMBL11807619 0.83 KCNE1 (0.35) KMT2AKCNE1KCNQ1
SCHEMBL11811219 0.82 POLB (0.33) MEN1KMT2AKCNA5
SCHEMBL11811508 0.81 CA12 (0.36) KCNA5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3946048-A HERBICIDES BASF AKTIENGESELLSCHAFT (DT) 1976-03-23 US claimed
US-3946048-A HERBICIDES BASF AKTIENGESELLSCHAFT (DT) 1976-03-23 US disclosed