SCHEMBL23929312

SCHEMBL23929312

O=c1[nH]c2cnc(Cl)nc2n1C1CCSCC1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 16/20 0.44
JAK3 P52333 16/20 0.44
JAK1 P23458 9/20 0.41
TYK2 P29597 1/20 0.39
PRKDC P78527 1/20 0.38
HCAR1 Q9BXC0 1/20 0.38
TYRO3 Q06418 1/20 0.37
DYRK1B Q9Y463 1/20 0.37
CCNE2 O96020 1/20 0.36
CCNE1 P24864 1/20 0.36
CDK2 P24941 1/20 0.36

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
SCHEMBL29986979 1.00 JAK2 (0.44) JAK2JAK3JAK1TYK2PRKDC
SCHEMBL1781369 0.88 HCAR1 (0.48) JAK2JAK3JAK1TYK2HCAR1
SCHEMBL29501865 0.86 HCAR1 (0.50) JAK2JAK3JAK1HCAR1CCNE2
SCHEMBL1693604 0.86 HCAR1 (0.50) JAK2JAK3JAK1HCAR1CCNE2
SCHEMBL20299440 0.85 JAK2 (0.47) JAK2JAK3JAK1TYK2PRKDC
SCHEMBL29770995 0.85 JAK2 (0.47) JAK2JAK3JAK1TYK2PRKDC
SCHEMBL1693606 0.84 JAK2 (0.59) JAK2JAK3JAK1TYK2
SCHEMBL20359146 0.84 JAK2 (0.54) JAK2JAK3JAK1TYK2PRKDC
SCHEMBL23974060 0.84 JAK2 (0.44) JAK2JAK3JAK1TYK2PRKDC
SCHEMBL20329966 0.84 JAK2 (0.54) JAK2JAK3JAK1TYK2PRKDC

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
CN-113549092-B Tricyclic kinase inhibitors 山东轩竹医药科技有限公司 2022-10-18 CN disclosed
WO-2021213460-A1 TRICYCLIC KINASE INHIBITOR 山东轩竹医药科技有限公司 (CN) 2021-10-28 WO disclosed
WO-2021213460-A1 TRICYCLIC KINASE INHIBITOR 山东轩竹医药科技有限公司 (CN) 2021-10-28 WO disclosed
CN-113549092-A Tricyclic kinase inhibitors 山东轩竹医药科技有限公司 2021-10-26 CN disclosed