SCHEMBL11218370

SCHEMBL11218370

CC(=O)Nc1nc2c(n1S(=O)(=O)c1nncs1)CCC(C(=O)NN)=C2

nearest known ligand 0.32

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.32
▸ NOD1 Q9Y239 2/20 0.31
▸ AKT1 P31749 1/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ ALDH1A1 P00352 4/20 0.31
▸ SMN1; SMN2 Q16637 2/20 0.31
▸ HSD17B10 Q99714 2/20 0.31
▸ MAPK1 P28482 2/20 0.31
▸ TP53 P04637 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ POLB P06746 1/20 0.30
▸ CA12 O43570 1/20 0.30
▸ CA1 P00915 1/20 0.30
▸ CA9 Q16790 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL11304955 0.85 — —
SCHEMBL11225189 0.80 NOD1 (0.32) NOD1
SCHEMBL11364384 0.80 NOD1 (0.32) NOD1
SCHEMBL11224839 0.78 NOD1 (0.31) NOD1
SCHEMBL11221149 0.76 MAPT (0.38) LMNAKMT2AMEN1SMN1; SMN2TP53
SCHEMBL11371800 0.73 CA12 (0.41) LMNAKMT2AMEN1SMN1; SMN2TP53
SCHEMBL11215489 0.73 MEN1 (0.39) LMNANOD1KMT2AMEN1ALDH1A1
SCHEMBL11371124 0.71 NOD1 (0.34) NOD1
SCHEMBL11352246 0.69 NOD1 (0.34) NOD1
SCHEMBL11361453 0.69 NOD1 (0.34) NOD1SMN1; SMN2POLB

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4401817-A ANTIVIRAL AGENTS ELI LILLY AND COMPANY (US) 1983-08-30 — — US disclosed
US-4338329-A COMBATTING RHINOVIRUSES ELI LILLY AND COMPANY (US) 1982-07-06 — — US disclosed
US-4289782-A PARTICULARLY FOR INHIBITING GROWTH OF RHINOVIRUSES ELI LILLY AND COMPANY (US) 1981-09-15 — — US disclosed
US-4230868-A α-Alkyl-α-hydroxybenzyl-substituted 1-sulfonylbenzimidazoles ELI LILLY AND COMPANY (US) 1980-10-28 — — US disclosed
US-4174454-A VIRICIDES ELI LILLY AND COMPANY (US) 1979-11-13 — — US disclosed
Send feedback