SCHEMBL27870951

SCHEMBL27870951

O=C(O)Nc1ccc(C2CCCNC2)cc1

nearest known ligand 0.72

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 1/20 0.65

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
SCHEMBL13505339 0.92 JAK3 (0.76) JAK3
SCHEMBL30520105 0.92 JAK3 (0.76) JAK3
SCHEMBL28263687 0.86
SCHEMBL19668440 0.84
SCHEMBL19668496 0.84
SCHEMBL6920357 0.84
SCHEMBL27091789 0.83 HDAC8 (0.55) JAK3
Hydrochloric Acid SCHEMBL1992390 0.83
SCHEMBL29536548 0.82
SCHEMBL1995773 0.82

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102686563-A Substituted benzamide derivatives HOFFMANN LA ROCHE 2012-09-19 CN claimed
CN-102686563-A Substituted benzamide derivatives HOFFMANN LA ROCHE 2012-09-19 CN disclosed