SCHEMBL8062149

SCHEMBL8062149

COc1ccc(C(=O)C=Cc2cc(OC)c(OCc3ccccc3)cc2O)cc1OC

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 1/20 0.61
▸ TNFRSF1A P19438 5/20 0.58
▸ ABCG2 Q9UNQ0 3/20 0.57
▸ ABCB1 P08183 2/20 0.57
▸ SMPD1 P17405 1/20 0.57
▸ HDAC1 Q13547 1/20 0.57
▸ HDAC8 Q9BY41 1/20 0.57
▸ HDAC6 Q9UBN7 1/20 0.57
▸ NPC1 O15118 1/20 0.55
▸ HPGD P15428 1/20 0.55
▸ RAB9A P51151 1/20 0.55
▸ SMN1; SMN2 Q16637 1/20 0.55
▸ PDE4A P27815 1/20 0.53
▸ PDE4B Q07343 1/20 0.53
▸ PDE4C Q08493 1/20 0.53
▸ PDE4D Q08499 1/20 0.53
▸ SNCA P37840 1/20 0.52
▸ PTGER4 P35408 1/20 0.52
▸ PTGER2 P43116 1/20 0.52

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
SCHEMBL8064357 0.92 PTPN1 (0.54) PTPN1TNFRSF1AABCG2ABCB1SMPD1
SCHEMBL16246459 0.85 TNFRSF1A (0.76) TNFRSF1AABCG2ABCB1SMPD1HDAC1
SCHEMBL16246460 0.85 TNFRSF1A (0.76) TNFRSF1AABCG2ABCB1SMPD1HDAC1
SCHEMBL8052867 0.84 TNFRSF1A (0.58) PTPN1TNFRSF1AABCG2ABCB1SMPD1
SCHEMBL8064254 0.84 TNFRSF1A (0.55) PTPN1TNFRSF1AABCG2SMPD1HDAC1
SCHEMBL8064252 0.84 TNFRSF1A (0.55) PTPN1TNFRSF1AABCG2SMPD1HDAC1
SCHEMBL25301594 0.83 APP (0.70) TNFRSF1AABCG2NPC1HPGDRAB9A
SCHEMBL8064391 0.83 PTPN1 (0.56) PTPN1TNFRSF1AABCG2SMPD1HDAC1
SCHEMBL21643517 0.83 PDE4A (0.67) TNFRSF1AABCG2NPC1HPGDRAB9A
SCHEMBL29803332 0.83 PDE4A (0.67) TNFRSF1AABCG2NPC1HPGDRAB9A

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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