SCHEMBL9766751

SCHEMBL9766751

COC(=O)c1cc(Cl)ccc1S(=O)(=O)N=C=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.47
NR4A2 P43354 2/20 0.42
CDK1 P06493 1/20 0.42
SLC6A4 P31645 1/20 0.41
SLC6A3 Q01959 1/20 0.41
ACLY P53396 2/20 0.39
FLT1 P17948 1/20 0.39
FLT4 P35916 1/20 0.39
KDR P35968 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
TRPV4 Q9HBA0 1/20 0.38
CA2 P00918 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
POLB P06746 1/20 0.38
MCOLN3 Q8TDD5 1/20 0.38
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
LMNA P02545 1/20 0.38
CA1 P00915 1/20 0.37

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
SCHEMBL11334105 0.89 ABL1 (0.50) ABL1NR4A2SLC6A4SLC6A3ACLY
SCHEMBL9766827 0.83 CDK1 (0.42) CDK1SLC6A4SLC6A3ACLYCA2
SCHEMBL10838076 0.80 ACLY (0.47) NR4A2SLC6A4SLC6A3ACLYCA2
SCHEMBL6228820 0.80 CA1 (0.59) CA2MEN1KMT2APOLBKDM4E
SCHEMBL17078006 0.79 TRPV4 (0.56) ABL1NR4A2CDK1SLC6A4SLC6A3
SCHEMBL1017485 0.79 ABL1 (0.54) ABL1NR4A2CDK1SLC6A4SLC6A3
SCHEMBL10839608 0.78 XDH (0.43) CDK1CA2MEN1KMT2ACA1
SCHEMBL22827732 0.78 CA2 (0.61) ABL1NR4A2CDK1SLC6A4SLC6A3
SCHEMBL22827917 0.77 ABL1 (0.51) ABL1NR4A2CDK1SLC6A4SLC6A3
SCHEMBL19437639 0.77 ABL1 (0.51) ABL1NR4A2CDK1SLC6A4SLC6A3

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-5071470-A Pre- or postemergence BASF AKTIENGESELLSCHAFT (DE) 1991-12-10 US disclosed