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Sugi Predict / Compounds / Cyclopropane

Cyclopropane

Cyclopropane

SCHEMBL20599225

C1=Cc2cccc3cccc(c23)C1.C1CC1

nearest known ligand 0.40

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.40
▸ CYP3A4 P08684 2/20 0.40
▸ CA1 P00915 1/20 0.37
▸ CA2 P00918 1/20 0.37
▸ ALDH1A1 P00352 4/20 0.33
▸ HPGD P15428 4/20 0.33
▸ KDM4E B2RXH2 4/20 0.33
▸ HSD17B10 Q99714 4/20 0.33
▸ CYP1A2 P05177 2/20 0.33
▸ CYP1A1 P04798 1/20 0.33
▸ CYP1B1 Q16678 1/20 0.33
▸ CYP2C19 P33261 2/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ MEN1 O00255 2/20 0.32
▸ MAPT P10636 2/20 0.32
▸ NR4A1 P22736 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ APAF1 O14727 1/20 0.32
▸ USP2 O75604 1/20 0.32
▸ APP P05067 1/20 0.32

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
SCHEMBL20599002 1.00 TSHR (0.40) TSHRCYP3A4CA1CA2ALDH1A1
Cyclopentane SCHEMBL20599267 1.00 TSHR (0.40) TSHRCYP3A4CA1CA2ALDH1A1
Cyclohexane SCHEMBL7854755 1.00 TSHR (0.40) TSHRCYP3A4CA1CA2ALDH1A1
SCHEMBL27642281 0.96 TSHR (0.43) TSHRCYP3A4CA1CA2ALDH1A1
SCHEMBL7432807 0.96 TSHR (0.43) TSHRCYP3A4CA1CA2ALDH1A1
SCHEMBL7712 0.96 TSHR (0.43) TSHRCYP3A4CA1CA2ALDH1A1
SCHEMBL27642275 0.96 TSHR (0.43) TSHRCYP3A4CA1CA2ALDH1A1
SCHEMBL29376031 0.96 TSHR (0.43) TSHRCYP3A4CA1CA2ALDH1A1
SCHEMBL17685497 0.96 TSHR (0.43) TSHRCYP3A4CA1CA2ALDH1A1
SCHEMBL29555130 0.96 TSHR (0.43) TSHRCYP3A4CA1CA2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104570600-B Coloring composition, colored cured film, and display element JSR株式会社 2020-08-25 — — CN disclosed
CN-105045040-B Colorant, curable composition, cured film, display element, and solid-state imaging element JSR株式会社 2020-06-05 — — CN disclosed
CN-104007615-B Coloring composition, colored cured film, and display element JSR株式会社 2020-03-13 — — CN disclosed
CN-110320750-A Coloured composition, coloring cured film and its application, pigment polymer JSR株式会社 2019-10-11 — — CN disclosed
EP-3428238-A1 INK, TEXTILE PRINTING METHOD, PRINTED TEXTILE, INK AGENT FOR TEXTILE JSR Corporation (JP) 2019-01-16 — — EP disclosed
US-20190002717-A1 INK, TEXTILE PRINTING METHOD, PRINTED TEXTILE AND INK AGENT FOR TEXTILE JSR CORPORATION (JP) 2019-01-03 — — US disclosed
CN-108699365-A Ink, printing process, printed article and ink agent used for textiles JSR株式会社 2018-10-23 — — CN disclosed
CN-108572515-A Coloured composition, coloring cured film, colored filter, display element, light receiving element, light-emitting component and pigment compound JSR株式会社 2018-09-25 — — CN disclosed
CN-106062935-A Composition and organic thin-film transistor using same 住友化学株式会社 2016-10-26 — — CN disclosed
CN-105377829-A Method for continuously producing cyclic carbonate MARUZEN PETROCHEM CO LTD 2016-03-02 — — CN disclosed
CN-105045040-A Colorant, curable composition, cured film, display device and solid state imaging device Jsr 2015-11-11 — — CN disclosed
CN-104570600-A COLORING COMPOSITION, COLORED CURED FILM AND DISPLAY DEVICE JSR CORP 2015-04-29 — — CN disclosed
CN-104007615-A Coloring composition, coloring immobilizing membrane and display element JSR CORP 2014-08-27 — — CN disclosed
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