SCHEMBL29780871

SCHEMBL29780871

Nc1ccc(-c2nn(C3COC3)c3ncnc(N)c23)cc1F

nearest known ligand 0.66

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 20/20 0.66
▸ PIK3CA P42336 18/20 0.66
▸ PIK3CB P42338 18/20 0.66
▸ PIK3CG P48736 18/20 0.66
▸ PRKDC P78527 18/20 0.66
▸ ABL1 P00519 17/20 0.66
▸ EGFR P00533 17/20 0.66
▸ HCK P08631 17/20 0.66
▸ SRC P12931 17/20 0.66
▸ KDR P35968 17/20 0.66
▸ MTOR P42345 17/20 0.66
▸ EPHB4 P54760 16/20 0.66
▸ PI4KB Q9UBF8 14/20 0.66
▸ BTK Q06187 2/20 0.57

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
SCHEMBL24096492 1.00 PIK3CD (0.66) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL24096623 0.92 KDR (0.79) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL30320505 0.92 KDR (0.79) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL30320491 0.91 PIK3CD (0.61) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL24096501 0.91 PIK3CD (0.61) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL24096565 0.90 PIK3CD (0.70) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL30320502 0.90 PIK3CD (0.70) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL24096758 0.90 PIK3CD (0.69) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL29998830 0.90 PIK3CD (0.69) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL23997147 0.88 PIK3CD (0.77) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC

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-116583287-A Pyridazinone heterocyclic compound, preparation method and application thereof 四川科伦博泰生物医药股份有限公司 2023-08-11 — — CN disclosed
CN-116075513-A Inhibitors of NEK7 kinase 哈利亚治疗公司 2023-05-05 — — CN disclosed
EP-4161933-A1 INHIBITORS OF NEK7 KINASE Halia Therapeutics, Inc. (US) 2023-04-12 — — EP disclosed
WO-2022166610-A1 PYRIDAZINONE HETEROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF 四川科伦博泰生物医药股份有限公司 2022-08-11 — — WO disclosed
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