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Sugi Predict / Compounds / SCHEMBL7909104

SCHEMBL7909104

SCHEMBL7909104

CCCCC1CCC(CCc2ccc(C(F)(F)Oc3ccc(F)cc3)cc2)CC1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 5/20 0.39
▸ PPARG P37231 2/20 0.38
▸ PPARA Q07869 2/20 0.38
▸ HRH3 Q9Y5N1 1/20 0.36
▸ PPARD Q03181 1/20 0.35
▸ MAOA P21397 1/20 0.34

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
SCHEMBL7909098 1.00 MAOB (0.39) MAOBPPARGPPARAHRH3PPARD
SCHEMBL7902015 0.96 PPARG (0.39) MAOBPPARGPPARAPPARDMAOA
SCHEMBL7902012 0.96 PPARG (0.39) MAOBPPARGPPARAPPARDMAOA
SCHEMBL7915623 0.93 MAOB (0.40) MAOBPPARGPPARAMAOA
SCHEMBL7915629 0.93 MAOB (0.40) MAOBPPARGPPARAMAOA
SCHEMBL7731572 0.91 TSHR (0.39) MAOBPPARGHRH3MAOA
SCHEMBL7731577 0.91 TSHR (0.39) MAOBPPARGHRH3MAOA
SCHEMBL7729913 0.91 MAOB (0.43) MAOBPPARGPPARAHRH3PPARD
SCHEMBL7729917 0.91 MAOB (0.43) MAOBPPARGPPARAHRH3PPARD
SCHEMBL7909842 0.90 MAOB (0.40) MAOBPPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0786509-B1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY CHISSO CORP (JP) 2001-09-12 — — EP disclosed
EP-0786509-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY CHISSO CORPORATION (JP) 1997-07-30 — — EP disclosed