SCHEMBL6176196

SCHEMBL6176196

O=C(O)c1ccc2oc(-c3ccc(OCc4ccccc4)cc3)cc(=O)c2c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.59
TNKS O95271 1/20 0.59
MAPT P10636 4/20 0.56
NPC1 O15118 2/20 0.56
RAB9A P51151 2/20 0.56
KDM4E B2RXH2 1/20 0.56
ALDH1A1 P00352 1/20 0.56
ABCB1 P08183 3/20 0.56
NR4A1 P22736 1/20 0.54
NR4A2 P43354 1/20 0.54
NR4A3 Q92570 1/20 0.54
PTPN1 P18031 1/20 0.53
SIGMAR1 Q99720 1/20 0.53
BCHE P06276 2/20 0.53
ACHE P22303 2/20 0.53
CYP1A1 P04798 1/20 0.53
CYP1A2 P05177 1/20 0.53
CYP1B1 Q16678 1/20 0.53
PLA2G2A P14555 1/20 0.52
PLA2G4A P47712 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
SCHEMBL6177248 0.88 TNKS (0.66) L3MBTL1TNKSMAPTNPC1RAB9A
SCHEMBL10627793 0.85 ABCG2 (0.58) TNKSMAPTNPC1RAB9AKDM4E
SCHEMBL31238530 0.85 TNKS (0.66) TNKSMAPTNPC1RAB9AKDM4E
SCHEMBL1177191 0.83 TNKS (0.74) TNKSMAPTNPC1RAB9AKDM4E
SCHEMBL11562626 0.82 MAPT (0.72) TNKSMAPTNPC1RAB9AKDM4E
SCHEMBL11560525 0.81 MAPT (0.53) TNKSMAPTNPC1RAB9AKDM4E
SCHEMBL10626539 0.81 MAPT (0.73) TNKSMAPTNPC1RAB9AKDM4E
SCHEMBL11619136 0.81 ABCG2 (0.64) TNKSABCB1SIGMAR1BCHEABCG2
SCHEMBL28078087 0.78 MAOB (0.67) L3MBTL1TNKSMAPTNPC1RAB9A
SCHEMBL6174522 0.78 CYSLTR1 (0.73) L3MBTL1MAPTABCB1BCHEACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-10109982-A None JP disclosed
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
JP-H10109982-A FLAVONE DERIVATIVE AND MEDICINE CONTAINING THE SAME KOWA CO 1998-04-28 JP disclosed
EP-0834510-A2 Flavone derivative and medicine comprising the same KOWA CO. LTD. (JP) 1998-04-08 EP disclosed