SCHEMBL27363793

SCHEMBL27363793

C=CCOC(=O)NS(=O)(=O)Nn1ccnc1C

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CSNK2A2 P19784 1/20 0.32
CSNK2A1 P68400 1/20 0.32
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
AGTR2 P50052 1/20 0.31
BRD4 O60885 1/20 0.31
CASP1 P29466 1/20 0.30
CYP3A4 P08684 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
SCHEMBL27362843 0.70 CYP3A4 (0.38) KMT2ACYP3A4
SCHEMBL13843144 0.69 MEN1 (0.36) CSNK2A2CSNK2A1KMT2AMEN1CASP1
SCHEMBL27360280 0.68 CYP3A4 (0.33) KMT2AMEN1CYP3A4
SCHEMBL27507447 0.67 PSEN1 (0.38) KMT2ACYP3A4
SCHEMBL27352531 0.67 CA12 (0.33) CYP3A4
SCHEMBL28889147 0.65 KMT2A (0.50) KMT2AMEN1
SCHEMBL25962050 0.64 MEN1 (0.37) CSNK2A2CSNK2A1KMT2AMEN1CASP1
SCHEMBL11844069 0.64 NPSR1 (0.59) KMT2AMEN1
SCHEMBL6065065 0.64 MEN1 (0.39) CSNK2A2CSNK2A1KMT2AMEN1CASP1
SCHEMBL8587614 0.62 MEN1 (0.41) CSNK2A2CSNK2A1KMT2AMEN1CASP1

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
CN-1057091-C Novelc arbapenem derivatives MEIJI SEIKA CO (JP) 2000-10-04 CN disclosed
CN-1148390-A Novelc arbapenem derivatives MEIJI SEIKA CO (JP) 1997-04-23 CN disclosed