SCHEMBL6904467

SCHEMBL6904467

COc1c(OCc2ccccc2)cc2oc(-c3ccccc3)cc(=O)c2c1OC

nearest known ligand 0.70

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 4/20 0.70
ABCG2 Q9UNQ0 2/20 0.65
CREB1 P16220 2/20 0.63
L3MBTL1 Q9Y468 1/20 0.63
MAPT P10636 1/20 0.62
ACHE P22303 3/20 0.60
PPARG P37231 1/20 0.60
BCHE P06276 1/20 0.60
MEN1 O00255 2/20 0.59
ALDH1A1 P00352 2/20 0.59
KMT2A Q03164 2/20 0.59
KDM4E B2RXH2 1/20 0.57
NPC1 O15118 1/20 0.57
RAB9A P51151 1/20 0.57
SLCO2B1 O94956 1/20 0.57
PRSS1 P07477 1/20 0.57
PRSS2 P07478 1/20 0.57
PRSS3 P35030 1/20 0.57
FLT3 P36888 1/20 0.57

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
SCHEMBL30852834 0.96 ABCB1 (0.65) ABCB1ABCG2CREB1L3MBTL1MAPT
SCHEMBL8062100 0.93 MEN1 (0.71) ABCB1ABCG2L3MBTL1MAPTACHE
SCHEMBL21335353 0.91 CREB1 (0.74) ABCB1ABCG2CREB1L3MBTL1MAPT
SCHEMBL8052863 0.91 ABCB1 (0.64) ABCB1ABCG2L3MBTL1ACHEBCHE
SCHEMBL8052929 0.90 ABCB1 (0.69) ABCB1ABCG2L3MBTL1ACHEMEN1
SCHEMBL8068919 0.90 ABCB1 (0.73) ABCB1ABCG2L3MBTL1MAPTACHE
SCHEMBL738489 0.89 MEN1 (0.71) ABCB1ABCG2L3MBTL1ACHEMEN1
SCHEMBL24514601 0.88 ABCB1 (0.73) ABCB1ABCG2L3MBTL1ACHEMEN1
SCHEMBL4649969 0.88 ABCB1 (0.73) ABCB1ABCG2L3MBTL1ACHEMEN1
SCHEMBL7156543 0.88 ABCB1 (0.69) ABCB1ABCG2L3MBTL1ACHEMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6806257-B1 USING SUCH AS OROXYLIN A AND/OR WOGONIN; SEPTIC SHOCK, ANEURYSM, ANGIOTENSIN CONVERTING ENZYME INHIBITION; ANTIINFLAMMATORIES BOARD OF TRUSTEES OF SOUTHERN ILLINOIS UNIVERSITY 2004-10-19 US disclosed
WO-2001030342-A9 FLAVONES AS INDUCIBLE NITRIC OXIDE SYNTHASE INHIBITORS, CYCLOOXYGENASE-2 INHIBITORS AND POTASSIUM CHANNEL ACTIVATORS UNIV SOUTHERN ILLINOIS (US) 2001-10-18 WO disclosed
WO-2001030342-A1 FLAVONES AS INDUCIBLE NITRIC OXIDE SYNTHASE INHIBITORS, CYCLOOXYGENASE-2 INHIBITORS AND POTASSIUM CHANNEL ACTIVATORS BOARD OF TRUSTEES OF SOUTHERN ILLINOIS UNIVERSITY (US) 2001-05-03 WO 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
EP-0915864-A1 GASTROPROTECTIVE FLAVONE/FLAVANONE COMPOUNDS WITH THERAPEUTIC EFFECT ON INFLAMMATORY BOWEL DISEASE Dong A Pharmaceutical Co. Ltd. (KR) 1999-05-19 EP disclosed
WO-1998004541-A1 GASTROPROTECTIVE FLAVONE/FLAVANONE COMPOUNDS WITH THERAPEUTIC EFFECT ON INFLAMMATORY BOWEL DISEASE DONG A PHARMACEUTICAL CO., LTD. (KR) 1998-02-05 WO disclosed