SCHEMBL7605927

SCHEMBL7605927

O=c1cc(-c2ccccc2)oc2ccc(OCO)cc12

nearest known ligand 0.73

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.73
▸ NPC1 O15118 2/20 0.73
▸ RAB9A P51151 2/20 0.73
▸ KDM4E B2RXH2 1/20 0.73
▸ ALDH1A1 P00352 1/20 0.73
▸ ABCB1 P08183 1/20 0.69
▸ ABCG2 Q9UNQ0 1/20 0.69
▸ SIGMAR1 Q99720 13/20 0.68
▸ STS P08842 1/20 0.63
▸ PLA2G2A P14555 1/20 0.62
▸ PLA2G4A P47712 1/20 0.62
▸ CALM1 P0DP23 1/20 0.62
▸ PKM P14618 1/20 0.62
▸ FTO Q9C0B1 1/20 0.62

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
SCHEMBL27835584 0.86 SIGMAR1 (0.76) MAPTNPC1RAB9AKDM4EALDH1A1
SCHEMBL27816181 0.86 MAPT (0.70) MAPTNPC1RAB9AKDM4EALDH1A1
SCHEMBL28632889 0.86 ABCB1 (0.73) MAPTNPC1RAB9AKDM4EALDH1A1
SCHEMBL28647889 0.84 SIGMAR1 (0.78) MAPTNPC1RAB9AKDM4EALDH1A1
SCHEMBL31238513 0.84 SIGMAR1 (0.65) MAPTNPC1RAB9AKDM4EALDH1A1
SCHEMBL8786926 0.83 SIGMAR1 (0.78) MAPTNPC1RAB9AKDM4EALDH1A1
SCHEMBL28646380 0.83 ABCB1 (0.68) MAPTNPC1RAB9AKDM4EALDH1A1
SCHEMBL8786565 0.82 SIGMAR1 (0.80) SIGMAR1
SCHEMBL27835673 0.82 MAPT (0.64) MAPTNPC1RAB9AKDM4EALDH1A1
SCHEMBL8786494 0.82 SIGMAR1 (0.77) MAPTNPC1RAB9AKDM4EALDH1A1

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-0915864-B1 GASTROPROTECTIVE FLAVONE/FLAVANONE COMPOUNDS WITH THERAPEUTIC EFFECT ON INFLAMMATORY BOWEL DISEASE DONG A PHARM CO LTD (KR) 2002-09-04 — — EP 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
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