SCHEMBL24046780

SCHEMBL24046780

C#Cc1cc(-c2cc(=O)c3c(OC)cc(OC)cc3o2)ccc1O

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABCB1 P08183 3/20 0.65
▸ POLH Q9Y253 1/20 0.61
▸ PLG P00747 1/20 0.61
▸ MEN1 O00255 3/20 0.60
▸ KMT2A Q03164 3/20 0.60
▸ ALDH1A1 P00352 2/20 0.60
▸ KDM4E B2RXH2 2/20 0.60
▸ NPC1 O15118 2/20 0.60
▸ ABCG2 Q9UNQ0 2/20 0.60
▸ RAB9A P51151 1/20 0.60
▸ FLT3 P36888 1/20 0.57
▸ MKNK2 Q9HBH9 1/20 0.57
▸ IP6K2 Q9UHH9 1/20 0.57
▸ CYP19A1 P11511 1/20 0.57
▸ MAOB P27338 1/20 0.57
▸ MAPT P10636 2/20 0.56
▸ CYP1B1 Q16678 2/20 0.56
▸ CYP1A1 P04798 1/20 0.56
▸ CYP1A2 P05177 1/20 0.56
▸ POLB P06746 1/20 0.56

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
SCHEMBL24047003 0.86 ABCB1 (0.61) ABCB1POLHPLGMEN1KMT2A
SCHEMBL16894667 0.83 ABCB1 (0.74) ABCB1POLHPLGMEN1KMT2A
SCHEMBL24046782 0.82 CSNK2A2 (0.71) ABCB1POLHMEN1KMT2AALDH1A1
SCHEMBL311530 0.81 ABCB1 (0.82) ABCB1POLHPLGMEN1KMT2A
SCHEMBL29978577 0.81 ABCB1 (0.82) ABCB1POLHPLGMEN1KMT2A
Tetramethylluteolin SCHEMBL29725288 0.80 ABCB1 (0.80) ABCB1POLHPLGMEN1KMT2A
Tetramethylluteolin SCHEMBL29572571 0.80 ABCB1 (0.80) ABCB1POLHPLGMEN1KMT2A
Tetramethylluteolin SCHEMBL1421511 0.80 ABCB1 (0.80) ABCB1POLHPLGMEN1KMT2A
Trimethylapigenin SCHEMBL1421585 0.79 ABCB1 (1.00) ABCB1MEN1KMT2AALDH1A1KDM4E
Trimethylapigenin SCHEMBL29350875 0.79 ABCB1 (1.00) ABCB1MEN1KMT2AALDH1A1KDM4E

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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