SCHEMBL19436528

SCHEMBL19436528

NC(=O)c1ccc2c(c1)nc(N)n2CC=CCNC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.50
▸ JAK2 O60674 17/20 0.47
▸ JAK1 P23458 17/20 0.47
▸ TYK2 P29597 17/20 0.47
▸ JAK3 P52333 17/20 0.47
▸ PTGER4 P35408 1/20 0.41
▸ PPARG P37231 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
SCHEMBL19436567 1.00 KMT2A (0.50) KMT2AJAK2JAK1TYK2JAK3
SCHEMBL22121416 0.89 KMT2A (0.57) KMT2AJAK2JAK1TYK2JAK3
SCHEMBL19451470 0.84 STING1 (0.48) KMT2AJAK2JAK1TYK2JAK3
SCHEMBL28421225 0.84 STING1 (0.48) KMT2AJAK2JAK1TYK2JAK3
SCHEMBL29405998 0.84 STING1 (0.48) KMT2AJAK2JAK1TYK2JAK3
SCHEMBL20066406 0.84 KMT2A (0.47) KMT2AJAK2JAK1TYK2JAK3
SCHEMBL22151665 0.83 KDM4E (0.55) KMT2AJAK2JAK1TYK2JAK3
SCHEMBL21643845 0.81 STING1 (0.42) KMT2A
SCHEMBL21643841 0.81 STING1 (0.42) KMT2A
SCHEMBL27204002 0.81 STING1 (0.41) KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3691640-A1 METHODS FOR ADMINISTERING STING AGONISTS GlaxoSmithKline Intellectual Property Development Limited (GB) 2020-08-12 — — EP disclosed
WO-2019069275-A1 METHODS FOR ADMINISTERING STING AGONISTS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-04-11 — — WO disclosed
EP-3440076-A1 HETEROCYCLIC AMIDES USEFUL AS PROTEIN MODULATORS GlaxoSmithKline Intellectual Property Development Ltd (GB) 2019-02-13 — — EP disclosed
WO-2017175147-A1 HETEROCYCLIC AMIDES USEFUL AS PROTEIN MODULATORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2017-10-12 — — WO disclosed
Send feedback