SCHEMBL8052936

SCHEMBL8052936

COc1ccc(C(=O)C=Cc2c(O)cc(OCc3ccccc3)cc2OC)cc1OC

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 1/20 0.57
▸ TNFRSF1A P19438 3/20 0.57
▸ MAOB P27338 1/20 0.54
▸ MEN1 O00255 1/20 0.52
▸ POLB P06746 1/20 0.52
▸ KMT2A Q03164 1/20 0.52
▸ ABCG2 Q9UNQ0 5/20 0.51
▸ ABCB1 P08183 1/20 0.51
▸ NPC1 O15118 1/20 0.51
▸ HPGD P15428 1/20 0.51
▸ RAB9A P51151 1/20 0.51
▸ SMN1; SMN2 Q16637 1/20 0.51
▸ GSK3B P49841 1/20 0.50
▸ APP P05067 1/20 0.50

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
SCHEMBL8064391 0.97 PTPN1 (0.56) PTPN1TNFRSF1AMAOBMEN1POLB
SCHEMBL17237769 0.86 MAOB (0.67) PTPN1TNFRSF1AMAOBMEN1KMT2A
SCHEMBL8052867 0.85 TNFRSF1A (0.58) PTPN1TNFRSF1AABCG2ABCB1NPC1
SCHEMBL8064254 0.83 TNFRSF1A (0.55) PTPN1TNFRSF1AMAOBABCG2NPC1
SCHEMBL8064252 0.83 TNFRSF1A (0.55) PTPN1TNFRSF1AMAOBABCG2NPC1
SCHEMBL4883621 0.83 ABCG2 (0.65) PTPN1MAOBMEN1POLBKMT2A
SCHEMBL5318918 0.83 ABCG2 (0.65) PTPN1MAOBMEN1POLBKMT2A
SCHEMBL27705774 0.82 MAOB (0.71) PTPN1TNFRSF1AMAOBMEN1KMT2A
SCHEMBL27705775 0.82 MAOB (0.71) PTPN1TNFRSF1AMAOBMEN1KMT2A
SCHEMBL8066764 0.82 TNFRSF1A (0.54) PTPN1TNFRSF1AABCG2ABCB1NPC1

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
US-6025387-A Gastroprotective flavone/flavanone compounds with therapeutic effect on inflammatory bowel disease DONG A PHARMACEUTICAL CO., LTD. (KR) 2000-02-15 — — US disclosed
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