SCHEMBL6719797

SCHEMBL6719797

CC(C)(O)C#Cc1ccc(OCCCCCO)cc1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.47
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ LMNA P02545 1/20 0.43
▸ APP P05067 6/20 0.41
▸ HAO1 Q9UJM8 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ NR5A1 Q13285 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ HRH3 Q9Y5N1 2/20 0.38
▸ ACACB O00763 1/20 0.38

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
SCHEMBL6724461 0.89 MAPT (0.50) MAPTL3MBTL1LMNAAPPHAO1
SCHEMBL6132763 0.88 MAPT (0.50) MAPTL3MBTL1LMNAHAO1GAA
SCHEMBL6133198 0.88 MAPT (0.50) MAPTL3MBTL1LMNAHAO1GAA
SCHEMBL6320559 0.88 NR5A1 (0.56) MAPTL3MBTL1LMNAGAANR5A1
SCHEMBL6324406 0.88 NR5A1 (0.56) MAPTL3MBTL1LMNAGAANR5A1
SCHEMBL7690566 0.84 RARB (0.54) MAPTL3MBTL1LMNAGAANR5A1
SCHEMBL23169795 0.81 MAPT (0.50) MAPTL3MBTL1LMNAHAO1GAA
SCHEMBL27573986 0.79 L3MBTL1 (0.50) MAPTL3MBTL1LMNAAPPHAO1
SCHEMBL19621751 0.77 PRMT1 (0.54) L3MBTL1GAANR5A1HRH3
SCHEMBL17088427 0.76 DRD2 (0.45) L3MBTL1APPGAANR5A1

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
US-6673267-B2 EXHIBING HIGH REFRACTIVE INDEX ANISOTROPY; PHOTOSTABILITY; USEFUL IN PRODUCING COLORED FILMS, DISPLAYS, OPTICAL RECORDING MATERIALS, OPTICAL COMPENSATORS, POLARIZERS, REFLECTOR PLATES, AND SCATTERING PLATES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-01-06 — — US disclosed
US-20020006479-A1 Phenylacetylene compound, liquid crystal composition, polymer, optically anisotropic product, and liquid crystal or optical element SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-01-17 — — US disclosed
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