SCHEMBL6176722

SCHEMBL6176722

CCOC(=O)c1cccc2c(=O)cc(-c3ccc(OCc4ccccc4)cc3)oc12

nearest known ligand 0.78

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 5/20 0.57
MAOB P27338 2/20 0.55
CYP1A1 P04798 1/20 0.55
CYP1A2 P05177 1/20 0.55
CYP1B1 Q16678 1/20 0.55
TNKS O95271 1/20 0.52
KDM4E B2RXH2 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
PPARG P37231 1/20 0.48
MEN1 O00255 1/20 0.47
HSP90AA1 P07900 1/20 0.47
KMT2A Q03164 1/20 0.47
PRKDC P78527 1/20 0.46
ABCB1 P08183 1/20 0.45
MAPT P10636 1/20 0.45

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
SCHEMBL6177306 0.91 CYSLTR1 (0.57) CYSLTR1MAOBTNKSKDM4EPPARG
SCHEMBL6176117 0.91 CYSLTR1 (0.58) CYSLTR1MAOBCYP1A1CYP1A2CYP1B1
SCHEMBL6174522 0.88 CYSLTR1 (0.73) CYSLTR1CYP1A1CYP1A2CYP1B1L3MBTL1
SCHEMBL8874138 0.88 CYSLTR1 (0.59) CYSLTR1MAOBCYP1A1CYP1A2CYP1B1
SCHEMBL6177041 0.85 TNKS (0.57) CYSLTR1MAOBCYP1A1CYP1A2CYP1B1
SCHEMBL6175634 0.84 CYSLTR1 (0.79) CYSLTR1
SCHEMBL6178507 0.83 CYSLTR1 (0.52) CYSLTR1MAOBCYP1A1CYP1A2CYP1B1
SCHEMBL6178502 0.83 CYSLTR1 (0.80) CYSLTR1MAOBCYP1A1CYP1A2CYP1B1
SCHEMBL24533170 0.81 CYSLTR1 (0.73) CYSLTR1CYP1A1CYP1A2CYP1B1TNKS
SCHEMBL6177248 0.80 TNKS (0.66) MAOBCYP1A1CYP1A2CYP1B1TNKS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0834510-B1 Flavone derivative and medicine comprising the same KOWA CO (JP) 2005-02-23 EP disclosed
US-6136848-A ANTIALLERGENS; ASTHMA THERAPY KOWA CO., LTD. (JP) 2000-10-24 US disclosed
EP-0834510-A2 Flavone derivative and medicine comprising the same KOWA CO. LTD. (JP) 1998-04-08 EP disclosed