SCHEMBL11197862

SCHEMBL11197862

COC(CNC(=O)Nc1nnc(S(=O)(=O)N(C)C)s1)OC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 10/20 0.43
▸ MEN1 O00255 9/20 0.43
▸ TP53 P04637 5/20 0.42
▸ THRB P10828 1/20 0.42
▸ CA12 O43570 3/20 0.41
▸ CA1 P00915 3/20 0.41
▸ CA2 P00918 3/20 0.41
▸ CA3 P07451 3/20 0.41
▸ CA4 P22748 3/20 0.41
▸ CA6 P23280 3/20 0.41
▸ CA5A P35218 3/20 0.41
▸ CA7 P43166 3/20 0.41
▸ CA9 Q16790 3/20 0.41
▸ CA13 Q8N1Q1 3/20 0.41
▸ CA14 Q9ULX7 3/20 0.41
▸ CA5B Q9Y2D0 3/20 0.41
▸ POLB P06746 2/20 0.41
▸ MAPT P10636 5/20 0.41
▸ RXFP1 Q9HBX9 1/20 0.40
▸ GAA P10253 1/20 0.40

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
SCHEMBL11162712 0.81 KMT2A (0.43) KMT2AMEN1TP53THRBCA12
SCHEMBL11562150 0.77 CA1 (0.53) KMT2AMEN1THRBCA12CA1
SCHEMBL11815674 0.77 TP53 (0.46) KMT2AMEN1TP53THRBCA12
SCHEMBL11392583 0.74 CA1 (0.69) KMT2AMEN1THRBCA12CA1
SCHEMBL11563584 0.74 CA12 (0.46) KMT2AMEN1TP53THRBCA12
SCHEMBL11167750 0.74 KMT2A (0.53) KMT2AMEN1TP53POLBMAPT
SCHEMBL11566445 0.73 CA1 (0.50) KMT2AMEN1THRBCA12CA1
SCHEMBL11563034 0.72 MAPT (0.46) KMT2AMEN1TP53THRBCA12
SCHEMBL11169766 0.71 MAPT (0.52) KMT2AMEN1TP53THRBPOLB
SCHEMBL11559048 0.68 MAPT (0.52) KMT2AMEN1TP53THRBCA12

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
EP-0094181-A1 Use of thiadiazolylimidazolidinones to control aquatic vegetation ELI LILLY AND COMPANY (US) 1983-11-16 — — EP disclosed
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