SCHEMBL6851806

SCHEMBL6851806

NC(=O)CNS(=O)(=O)c1cc(Cl)c(Cl)cc1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.47
POLB P06746 2/20 0.43
KMT2A Q03164 2/20 0.43
GAA P10253 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA3 P07451 1/20 0.41
CA4 P22748 1/20 0.41
CA6 P23280 1/20 0.41
CA5A P35218 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA13 Q8N1Q1 1/20 0.41
CA14 Q9ULX7 1/20 0.41
CA5B Q9Y2D0 1/20 0.41
ALDH1A1 P00352 3/20 0.40
TSHR P16473 2/20 0.40
HSD17B10 Q99714 1/20 0.40
TDP1 Q9NUW8 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
SCHEMBL6846253 0.82 GAA (0.52) POLBGAAALDH1A1TSHRHSD17B10
SCHEMBL25369766 0.79 CA1 (0.58) CA12CA1CA2CA3CA4
SCHEMBL9577136 0.77 POLB (0.54) ATMPOLBKMT2AGAAALDH1A1
SCHEMBL6761822 0.76 PTGES2 (0.49) KMT2AALDH1A1TSHRHSD17B10TDP1
SCHEMBL6849946 0.74 FABP4 (0.55) MEP1B
SCHEMBL4029646 0.73 WDR5 (0.48) POLBKMT2AGAAALDH1A1MEP1B
SCHEMBL9577182 0.73 POLB (0.50) ATMPOLBKMT2AGAAALDH1A1
SCHEMBL6851801 0.72 CA1 (0.49) ATMKMT2ACA12CA1CA2
SCHEMBL6762534 0.72 SLC1A3 (0.48) ATMPOLBKMT2AGAAHSD17B10
SCHEMBL31135459 0.72 CA1 (0.46) ATMKMT2AGAACA12CA1

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-6774212-B2 FOR THERAPY OF VIRAL INFECTION OR AS AN ASSAY STANDARD OR REAGENT BRISTOL-MYERS SQUIBB PHARMA COMPANY 2004-08-10 US disclosed