SCHEMBL11141268

SCHEMBL11141268

CCCCCCCCSc1ncnc(Oc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGS1 P23219 3/20 0.36
▸ GAA P10253 2/20 0.36
▸ HTT P42858 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ PTGS2 P35354 1/20 0.36
▸ CA1 P00915 1/20 0.36
▸ CA2 P00918 1/20 0.36
▸ SMN1; SMN2 Q16637 4/20 0.36
▸ GPR84 Q9NQS5 7/20 0.35
▸ PTGES O14684 2/20 0.35
▸ MAPT P10636 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ HPN P05981 1/20 0.33

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
SCHEMBL11713623 0.93 PTGS1 (0.34) PTGS1GAAHTTKDM4EMEN1
SCHEMBL11170888 0.88 CA1 (0.40) PTGS1PTGS2CA1CA2SMN1; SMN2
SCHEMBL11863295 0.88 CA1 (0.40) PTGS1PTGS2CA1CA2SMN1; SMN2
SCHEMBL39436 0.88 CA1 (0.40) PTGS1PTGS2CA1CA2SMN1; SMN2
SCHEMBL11176405 0.88 CA1 (0.40) PTGS1PTGS2CA1CA2SMN1; SMN2
SCHEMBL11713619 0.86 CA1 (0.33) PTGS1PTGS2CA1CA2MAPT
SCHEMBL24175851 0.85 PTGS1 (0.36) PTGS1GAAHTTKDM4EMEN1
SCHEMBL11169685 0.84 PTGS1 (0.36) PTGS1PTGS2CA1CA2SMN1; SMN2
SCHEMBL11174053 0.84 PTGS1 (0.36) PTGS1PTGS2CA1CA2SMN1; SMN2
SCHEMBL11165374 0.83 CA1 (0.41) PTGS1GAAL3MBTL1PTGS2CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112143433-B Low-dielectric-constant adhesive and preparation method thereof 中瀚新材料科技有限公司 2022-05-24 — — CN disclosed
CN-108440851-B Environment-friendly ethylene propylene diene monomer rubber tube and preparation method thereof 山东东都汽车部件股份有限公司 2022-02-25 — — CN disclosed
CN-106422815-B High-temperature-resistant PVDF (polyvinylidene fluoride) crystalline material 常州大学 2022-01-14 — — CN disclosed
CN-108642590-B Anti-mosquito fabric material and preparation method and application thereof 帱益天下纺织科技(广东)有限公司 2021-07-23 — — CN disclosed
CN-107880988-B Environment-friendly forming oil for stainless steel and preparation method thereof 广州市联诺化工科技有限公司 2021-02-09 — — CN disclosed
CN-112143433-A Low-dielectric-constant adhesive and preparation method thereof 中瀚新材料科技有限公司 2020-12-29 — — CN disclosed
CN-107189174-B Alkaline mineral material and preparation method and application thereof 浙江苏达山新材料有限公司 2020-10-20 — — CN disclosed
CN-106883664-B Benzene-series pollutant remover and preparation method thereof 孙科 2020-09-08 — — CN disclosed
CN-106750818-B Heat-shrinkable composition for protecting vehicle pipelines and internal tooth heat-shrinkable sleeve prepared from same 大连联合高分子材料有限公司 2020-02-07 — — CN disclosed
CN-108825351-B Pressure-bearing expansion water tank 山东东都汽车部件股份有限公司 2019-12-31 — — CN disclosed
CN-107163379-B bio-based composite material and preparation method and application thereof 浙江苏达山新材料有限公司 2019-12-17 — — CN disclosed
US-4419471-A BUTADIENE-STYRENE CORE WITH ANTIOXIDANT, ACRYLATE SHELL WITH PHOTOSTABILIZER GAF CORPORATION (US) 1983-12-06 — — US disclosed
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