SCHEMBL19823063

SCHEMBL19823063

CC(C)C(=O)Nc1nc2c(-c3ccc(CN4CC(CCC5CC5)C4)cc3)cccn2n1

nearest known ligand 0.76

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
JAK1 P23458 9/20 0.76
JAK3 P52333 12/20 0.49
JAK2 O60674 11/20 0.45
PTK2 Q05397 11/20 0.45

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
SCHEMBL24062643 0.91 JAK1 (0.75) JAK1JAK3JAK2PTK2
SCHEMBL19823053 0.89 JAK1 (0.80) JAK1JAK3JAK2PTK2
SCHEMBL21078397 0.88 JAK1 (0.76) JAK1JAK3JAK2PTK2
SCHEMBL19823061 0.88 JAK1 (0.75) JAK1JAK3JAK2
SCHEMBL21044831 0.86 JAK1 (1.00) JAK1JAK3JAK2PTK2
SCHEMBL22110347 0.86 JAK1 (1.00) JAK1JAK3JAK2PTK2
SCHEMBL21044810 0.85 JAK1 (1.00) JAK1JAK3JAK2PTK2
SCHEMBL19823062 0.81 JAK1 (0.75) JAK1JAK3JAK2PTK2
SCHEMBL21078373 0.79 JAK1 (0.75) JAK1JAK3JAK2
SCHEMBL24062654 0.78 JAK1 (0.80) JAK1JAK3JAK2PTK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3492469-B1 COMPOUND AS SELECTIVE JAK INHIBITOR, AND SALT AND THERAPEUTIC USE THEREOF SUZHOU LONGBIOTECH PHARMACEUTICALS CO LTD (CN) 2021-12-01 EP disclosed
EP-3492469-A1 COMPOUND AS SELECTIVE JAK INHIBITOR, AND SALT AND THERAPEUTIC USE THEREOF Tianjin Longbogene Pharmaceutical Co., Ltd. (CN) 2019-06-05 EP disclosed
WO-2018019223-A1 COMPOUND AS SELECTIVE JAK INHIBITOR, AND SALT AND THERAPEUTIC USE THEREOF 张文燕 2018-02-01 WO disclosed