SCHEMBL11371124

SCHEMBL11371124

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

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ NOD1 Q9Y239 2/20 0.34

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
SCHEMBL11350489 0.87 LMNA (0.32) —
SCHEMBL11352246 0.83 NOD1 (0.34) NOD1
SCHEMBL11361453 0.83 NOD1 (0.34) NOD1
SCHEMBL11376616 0.81 NOD1 (0.33) NOD1
SCHEMBL11383065 0.81 NOD1 (0.30) NOD1
SCHEMBL11302735 0.80 PI4KB (0.36) —
SCHEMBL11371800 0.76 CA12 (0.41) —
SCHEMBL11225189 0.75 NOD1 (0.32) NOD1
SCHEMBL11364384 0.75 NOD1 (0.32) NOD1
SCHEMBL11307520 0.72 — —

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-4316021-A VIRICIDES ELI LILLY AND COMPANY (US) 1982-02-16 — — US disclosed
US-4243813-A VIRICIDES ELI LILLY AND COMPANY (US) 1981-01-06 — — US disclosed
US-4196125-A VIRICIDES ELI LILLY AND COMPANY (US) 1980-04-01 — — US disclosed
US-4118573-A ANTIVIRAL AGENTS ELI LILLY AND COMPANY (US) 1978-10-03 — — US disclosed
US-4018790-A VIRICIDES ELI LILLY AND COMPANY (US) 1977-04-19 — — US disclosed
Send feedback