SCHEMBL11800905

SCHEMBL11800905

CNC(=O)NC.NS(=O)(=O)c1nncs1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 14/20 0.42
CA1 P00915 13/20 0.42
CA4 P22748 7/20 0.42
CA5A P35218 3/20 0.42
CA5B Q9Y2D0 3/20 0.42
KMT2A Q03164 2/20 0.39
CA9 Q16790 6/20 0.38
CA12 O43570 2/20 0.38
CA3 P07451 2/20 0.38
CA6 P23280 2/20 0.38
CA7 P43166 2/20 0.38
CA13 Q8N1Q1 2/20 0.38
CA14 Q9ULX7 2/20 0.38
MEN1 O00255 1/20 0.38
CA11 O75493 1/20 0.38
THRB P10828 1/20 0.38
BLM P54132 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
AKT1 P31749 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
SCHEMBL2399941 0.84
SCHEMBL5097249 0.82 CA2 (0.48) CA2CA1CA4CA5ACA5B
Benzenesulfonamide SCHEMBL11048441 0.71 CA2 (0.55) CA2CA1CA4CA5ACA5B
Phenylthiourea SCHEMBL5490215 0.69 ALDH1A1 (0.51) CA2CA1CA5ACA5BKMT2A
SCHEMBL11623839 0.68 TAAR1 (0.60) KMT2ASMN1; SMN2TAAR1
SCHEMBL2323882 0.68
SCHEMBL3400951 0.67 CA1 (0.46) CA2CA1CA4CA5ACA5B
SCHEMBL7369364 0.67 CA1 (0.43) CA2CA1CA4CA5ACA5B
SCHEMBL3337911 0.65 CA1 (0.34) CA2CA1CA4CA5ACA5B
SCHEMBL12854179 0.65 CA1 (0.38) CA2CA1CA4CA5ACA5B

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-4021225-A HERBICIDES GULF RESEARCH & DEVELOPMENT COMPANY (US) 1977-05-03 US disclosed