SCHEMBL11814747

SCHEMBL11814747

CCOC1Oc2ccc(NS(=O)(=O)O)cc2C1(C)C

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 10/20 0.35
PGR P06401 3/20 0.35
NR3C2 P08235 3/20 0.35
MAPT P10636 1/20 0.34
PTPN1 P18031 4/20 0.33
PTPRB P23467 4/20 0.32
ACP1 P24666 1/20 0.32
HPGD P15428 1/20 0.32
RECQL P46063 1/20 0.32

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
SCHEMBL11804859 0.91 NR3C1 (0.34) NR3C1PGRNR3C2MAPTPTPN1
SCHEMBL11808628 0.86 PTPN1 (0.31) NR3C1PGRNR3C2PTPN1PTPRB
SCHEMBL11815727 0.86 PTPN1 (0.37) NR3C1PGRNR3C2PTPN1PTPRB
SCHEMBL11809465 0.83 PTPN1 (0.34) NR3C1PGRNR3C2PTPN1PTPRB
SCHEMBL11570113 0.81 ALDH1A1 (0.33) HPGD
Ethofumesate SCHEMBL27295007 0.80 ALDH1A1 (0.36) MAPTHPGD
SCHEMBL11806771 0.79 NR3C2 (0.34) NR3C1NR3C2MAPTPTPN1PTPRB
SCHEMBL11809291 0.79 CA1 (0.31) HPGD
SCHEMBL11805859 0.79
SCHEMBL11809296 0.79 SMN1; SMN2 (0.35) MAPT

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