SCHEMBL7603349

SCHEMBL7603349

COc1ccc(-c2cc(=O)c3c(OC)cc(OCCO)cc3o2)cc1OC

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.64
ABCB1 P08183 6/20 0.61
MEN1 O00255 5/20 0.61
KMT2A Q03164 5/20 0.61
ABCG2 Q9UNQ0 4/20 0.61
TP53 P04637 1/20 0.61
MDM2 Q00987 1/20 0.61
CYP1B1 Q16678 3/20 0.61
CYP1A1 P04798 2/20 0.60
CYP1A2 P05177 1/20 0.60
OPRD1 P41143 1/20 0.60
HDAC6 Q9UBN7 1/20 0.58
MAOA P21397 2/20 0.57
MAOB P27338 2/20 0.57
KDM4E B2RXH2 4/20 0.56
ALDH1A1 P00352 3/20 0.56
NPC1 O15118 1/20 0.56
RAB9A P51151 1/20 0.56
POLH Q9Y253 1/20 0.55
CYP3A4 P08684 3/20 0.54

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
Tetramethylluteolin SCHEMBL29725288 0.86 ABCB1 (0.80) ABCB1MEN1KMT2AABCG2TP53
Tetramethylluteolin SCHEMBL29572571 0.86 ABCB1 (0.80) ABCB1MEN1KMT2AABCG2TP53
Tetramethylluteolin SCHEMBL1421511 0.86 ABCB1 (0.80) ABCB1MEN1KMT2AABCG2TP53
Recoflavone SCHEMBL29406117 0.86 ABCB1 (0.59) ABCB1MEN1KMT2AABCG2TP53
SCHEMBL2481857 0.86 MEN1 (0.59) ABCB1MEN1KMT2AABCG2TP53
Recoflavone SCHEMBL2483541 0.86 ABCB1 (0.59) ABCB1MEN1KMT2AABCG2TP53
Recoflavone SCHEMBL4829847 0.86 ABCB1 (0.56) BRD4ABCB1MEN1KMT2AABCG2
SCHEMBL8309779 0.86 ABCB1 (0.56) BRD4ABCB1MEN1KMT2AABCG2
SCHEMBL7632339 0.85 ABCB1 (0.58) BRD4ABCB1MEN1KMT2AABCG2
Recoflavone SCHEMBL2483546 0.85 ABCB1 (0.58) ABCB1MEN1KMT2AABCG2TP53

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
EP-0915864-B1 GASTROPROTECTIVE FLAVONE/FLAVANONE COMPOUNDS WITH THERAPEUTIC EFFECT ON INFLAMMATORY BOWEL DISEASE DONG A PHARM CO LTD (KR) 2002-09-04 EP claimed
US-6025387-A Gastroprotective flavone/flavanone compounds with therapeutic effect on inflammatory bowel disease DONG A PHARMACEUTICAL CO., LTD. (KR) 2000-02-15 US claimed
EP-0915864-B1 GASTROPROTECTIVE FLAVONE/FLAVANONE COMPOUNDS WITH THERAPEUTIC EFFECT ON INFLAMMATORY BOWEL DISEASE DONG A PHARM CO LTD (KR) 2002-09-04 EP disclosed
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