SCHEMBL24046779

SCHEMBL24046779

O=c1cc(CCc2cncnn2)oc2ccccc12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 3/20 0.57
▸ CYP11B1 P15538 2/20 0.50
▸ CYP11B2 P19099 2/20 0.50
▸ SIGMAR1 Q99720 2/20 0.41
▸ TNKS O95271 2/20 0.38
▸ PLA2G2A P14555 1/20 0.38
▸ PLA2G4A P47712 1/20 0.38
▸ GABRP O00591 1/20 0.38
▸ GABRD O14764 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ CA12 O43570 1/20 0.38
▸ CA1 P00915 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ ABCB1 P08183 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ PARP1 P09874 1/20 0.38
▸ ADORA3 P0DMS8 1/20 0.38
▸ AR P10275 1/20 0.38
▸ CYP19A1 P11511 1/20 0.38

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
SCHEMBL24046789 0.76 PPARG (0.59) PPARGCYP11B1CYP11B2SIGMAR1TNKS
SCHEMBL24046786 0.76 PPARG (0.62) PPARGCYP11B1CYP11B2SIGMAR1TNKS
SCHEMBL24046842 0.74 PPARG (0.78) PPARGCYP11B1CYP11B2SIGMAR1PLA2G2A
SCHEMBL24046843 0.74 PPARG (0.72) PPARGCYP11B1CYP11B2SIGMAR1HPGD
Flidersiachromone SCHEMBL5826185 0.73 PPARG (1.00) PPARGCYP11B1CYP11B2SIGMAR1TNKS
Flidersiachromone SCHEMBL29408800 0.73 PPARG (1.00) PPARGCYP11B1CYP11B2SIGMAR1TNKS
SCHEMBL19925815 0.71 PPARG (0.69) PPARGCYP11B1CYP11B2SIGMAR1TNKS
SCHEMBL292258 0.71 PPARG (0.69) PPARGCYP11B1CYP11B2SIGMAR1TNKS
SCHEMBL3715533 0.71 PPARG (0.69) PPARGCYP11B1CYP11B2SIGMAR1TNKS
SCHEMBL30694898 0.71 PPARG (0.69) PPARGCYP11B1CYP11B2SIGMAR1TNKS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021236578-A1 CHROMEN-4-ONE DERIVATIVES, SUCH AS E.G. FLAVONES, FOR USE AS CK2 INHIBITORS FOR THE TREATMENT OF NEUROINFLAMMATION SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 2021-11-25 — — WO disclosed
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