SCHEMBL9830751

SCHEMBL9830751

[CH]=Cc1ccc(CCCC)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 1/20 0.49
GRIN3B O60391 1/20 0.49
GRIN1 Q05586 1/20 0.49
GRIN2A Q12879 1/20 0.49
GRIN2B Q13224 1/20 0.49
GRIN2C Q14957 1/20 0.49
GRIN3A Q8TCU5 1/20 0.49
CA2 P00918 2/20 0.48
CA1 P00915 1/20 0.48
ALDH1A1 P00352 2/20 0.47
HSD17B10 Q99714 2/20 0.47
HPGD P15428 2/20 0.47
THRA P10827 1/20 0.46
THRB P10828 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ESR1 P03372 2/20 0.45
ADRA2A P08913 2/20 0.45
ADORA3 P0DMS8 2/20 0.45
TACR2 P21452 2/20 0.45
SLC6A2 P23975 2/20 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
SCHEMBL517505 0.94 ESR1 (0.53) CA2ALDH1A1HSD17B10THRATHRB
SCHEMBL10385709 0.92 ESR1 (0.57) ALDH1A1HSD17B10THRATHRBESR1
SCHEMBL8746582 0.92 ESR1 (0.57) ALDH1A1HSD17B10THRATHRBESR1
SCHEMBL9830053 0.92 ESR1 (0.57) ALDH1A1HSD17B10THRATHRBESR1
SCHEMBL2167123 0.92 ESR1 (0.57) ALDH1A1HSD17B10THRATHRBESR1
SCHEMBL8709295 0.86 LPL (0.45) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL5426214 0.82 CA2 (0.52) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL83869 0.81 CA2 (0.65) CA2CA1ALDH1A1HSD17B10HPGD
SCHEMBL1610637 0.80 CA2 (0.50) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL329513 0.80 CA2 (0.50) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117580842-A Compound, composition for anisotropic dye film comprising same, anisotropic dye film, and optical element 三菱化学株式会社 2024-02-20 CN disclosed
CN-116615332-A Optically anisotropic laminate and optical element 三菱化学株式会社 2023-08-18 CN disclosed
CN-116034140-A Compound, composition for anisotropic dye film comprising same, anisotropic dye film, and optical element 三菱化学株式会社 2023-04-28 CN disclosed
CN-111788505-B Composition for forming anisotropic dye film, and optical element 三菱化学株式会社 2022-10-04 CN disclosed
CN-113490871-A Composition for forming anisotropic dye film, and optical element 三菱化学株式会社 2021-10-08 CN disclosed
CN-111788505-A Composition for forming anisotropic dye film, and optical element 三菱化学株式会社 2020-10-16 CN disclosed
WO-2019181888-A1 COMPOSITION FOR FORMING ANISOTROPIC DYE FILM, ANISOTROPIC DYE FILM AND OPTICAL ELEMENT 三菱ケミカル株式会社 2019-09-26 WO disclosed
EP-0304613-B1 BENZOPYRAN DERIVATIVES BASF Aktiengesellschaft (DE) 1991-06-26 EP disclosed
US-4958021-A PRESSURE AND HEAT SENSITIVE RECORDING MATERIALS BASF AKTIENGESELLSCHAFT (DE) 1990-09-18 US disclosed
EP-0304613-A1 Benzopyran derivatives BASF Aktiengesellschaft (DE) 1989-03-01 EP disclosed