Cyclopentane

Cyclopentane

SCHEMBL28201515

C1CCCC1.CC(Cl)Cl.ClCCCl

nearest known ligand 0.46

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Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.46
ALDH1A1 P00352 3/20 0.46
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
MAPT P10636 1/20 0.32
LMNA P02545 1/20 0.30
TP53 P04637 1/20 0.30
HTT P42858 1/20 0.30
HBB P68871 1/20 0.30
MAPK1 P28482 1/20 0.30

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
1,2-Dichloroethane SCHEMBL36872 0.88
1,2-Dichloroethane SCHEMBL28875111 0.88 TSHR (0.60) TSHRALDH1A1MEN1KMT2AMAPK1
Cyclopropane SCHEMBL28633653 0.83
Cyclohexane SCHEMBL945649 0.83 ALDH1A1 (0.67) TSHRALDH1A1LMNA
Cyclohexane SCHEMBL945651 0.78 ALDH1A1 (0.62) TSHRALDH1A1MAPTLMNATP53
1,2-Dichloroethane SCHEMBL19614540 0.77 ALDH1A1 (0.46) TSHRALDH1A1MEN1KMT2AMAPK1
1,2-Dichloroethane SCHEMBL19614542 0.74 ALDH1A1 (0.43) TSHRALDH1A1MEN1KMT2A
Methylene Chloride SCHEMBL7463180 0.74 ALDH1A1 (0.67) TSHRALDH1A1MEN1KMT2ALMNA
Methylene Chloride SCHEMBL700799 0.74
1,2-Dichloroethane SCHEMBL8201807 0.72

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
CN-109996780-A Polymerizable compound, polymerizable composition, polymerizable composition, macromolecule, optical film, optically anisotropic body, polarizing film, panel display apparatus, organic electroluminescence display device and method of manufacturing same, antireflection film and compound 日本瑞翁株式会社 2019-07-09 CN disclosed
CN-107963997-A The manufacture method of compound, mixture and polymerizable compound 日本瑞翁株式会社 2018-04-27 CN disclosed
CN-105452311-B Polymerizable compound, polymerizable composition, polymer, and optically anisotropic body 日本瑞翁株式会社 2018-01-16 CN disclosed