SCHEMBL9540497

SCHEMBL9540497

[O]S(=O)(=O)N1CCCCCC1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.58
CA2 P00918 2/20 0.58
POLB P06746 1/20 0.58
TSHR P16473 5/20 0.55
KMT2A Q03164 2/20 0.55
USP2 O75604 1/20 0.46
KDM4E B2RXH2 1/20 0.46
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
ALDH1A1 P00352 3/20 0.41
MEN1 O00255 1/20 0.41
HPGD P15428 2/20 0.37
GAA P10253 1/20 0.36
FKBP1A P62942 1/20 0.35
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL9539931 1.00 CA1 (0.58) CA1CA2POLBTSHRKMT2A
SCHEMBL1335067 0.97
SCHEMBL9541853 0.90
SCHEMBL9544274 0.82
SCHEMBL5280013 0.76 POLB (0.93) CA1CA2POLBTSHRKMT2A
SCHEMBL392889 0.73 CA1 (1.00) CA1CA2POLBTSHRKMT2A
SCHEMBL2724764 0.73 CA1 (1.00) CA1CA2POLBTSHRKMT2A
SCHEMBL3937944 0.73 CA1 (0.58) CA1CA2POLBTSHRKMT2A
SCHEMBL21356989 0.73 CA1 (1.00) CA1CA2POLBTSHRKMT2A
SCHEMBL417152 0.73 CA1 (0.58) CA1CA2POLBTSHRKMT2A

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
WO-1993011669-A1 USE OF 3-PHENYLURACIL DERIVATIVES FOR THE DESICCATION AND ABSCISSION OF PLANT PARTS BASF AKTIENGESELLSCHAFT (DE) 1993-06-24 WO claimed