SCHEMBL544279

SCHEMBL544279

C#Cc1ccccc1OC(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IRAK4 Q9NWZ3 2/20 0.43
▸ ALDH1A1 P00352 2/20 0.41
▸ ACHE P22303 1/20 0.41
▸ NISCH Q9Y2I1 2/20 0.37
▸ ADRA2A P08913 1/20 0.37
▸ ADRA2B P18089 1/20 0.37
▸ ADRA2C P18825 1/20 0.37
▸ TLR8 Q9NR97 1/20 0.36
▸ MCHR1 Q99705 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ CYP1A2 P05177 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ CA1 P00915 1/20 0.34
▸ CA2 P00918 1/20 0.34
▸ CA7 P43166 1/20 0.34

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
SCHEMBL31173097 1.00 IRAK4 (0.43) IRAK4ALDH1A1ACHENISCHADRA2A
SCHEMBL1465246 0.79 IRAK4 (0.47) IRAK4ALDH1A1ACHENISCHADRA2A
SCHEMBL18297671 0.79 DRD1 (0.39) ALDH1A1KDM4EPOLBKMT2ASLC6A2
SCHEMBL31543913 0.79 DRD1 (0.39) ALDH1A1KDM4EPOLBKMT2ASLC6A2
SCHEMBL1871847 0.79 GAA (0.50) IRAK4ALDH1A1ACHEADRA2AADRA2B
SCHEMBL29530994 0.79 GAA (0.50) IRAK4ALDH1A1ACHEADRA2AADRA2B
Hydrochloric Acid SCHEMBL13857740 0.78 GAA (0.49) IRAK4ALDH1A1ACHEADRA2AADRA2B
SCHEMBL28867025 0.77 KCNH2 (0.36) IRAK4ALDH1A1MAPTMEN1KMT2A
SCHEMBL7944121 0.77 MAOB (0.31) ALDH1A1
SCHEMBL3256317 0.77 MAOB (0.34) ADRA2AADRA2BADRA2CCYP1A2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107531823-B Ruthenium-or osmium-based complex catalysts 阿朗新科德国有限责任公司 2020-11-17 — — CN claimed
US-10441948-B2 Ruthenium-or osmium-based complex catalysts ARLANXEO DEUTSCHLAND GMBH (DE) 2019-10-15 — — US claimed
EP-3283496-B1 RUTHENIUM- OR OSMIUM-BASED COMPLEX CATALYSTS ARLANXEO DEUTSCHLAND GMBH (DE) 2019-06-19 — — EP claimed
US-20180290134-A1 RUTHENIUM-OR OSMIUM-BASED COMPLEX CATALYSTS ARLANXEO DEUTSCHLAND GMBH (DE) 2018-10-11 — — US claimed
EP-3283496-A1 RUTHENIUM- OR OSMIUM-BASED COMPLEX CATALYSTS ARLANXEO Deutschland GmbH (DE) 2018-02-21 — — EP claimed
WO-2016166097-A1 RUTHENIUM- OR OSMIUM-BASED COMPLEX CATALYSTS ARLANXEO DEUTSCHLAND GMBH (DE) 2016-10-20 — — WO claimed
EP-3081572-A1 RUTHENIUM-OR OSMIUM-BASED COMPLEX CATALYSTS ARLANXEO Deutschland GmbH (DE) 2016-10-19 — — EP claimed
US-8110636-B1 Multi-block sulfonated poly(phenylene) copolymer proton exchange membranes SANDIA CORPORATION (US) 2012-02-07 — — US claimed
CN-114907297-B Method for preparing benzodihydrofuran derivative by tandem connection of visible light catalytic 2-alkynyl aryl ether and sulfonyl chloride 湖南警察学院 2024-09-24 — — CN disclosed
CN-114907297-A Method for preparing benzodihydrofuran derivative by visible light catalysis of 2-alkynyl aryl ether and sulfonyl chloride in series 湖南警察学院 2022-08-16 — — CN disclosed
CN-107531823-B Ruthenium-or osmium-based complex catalysts 阿朗新科德国有限责任公司 2020-11-17 — — CN disclosed
US-10441948-B2 Ruthenium-or osmium-based complex catalysts ARLANXEO DEUTSCHLAND GMBH (DE) 2019-10-15 — — US disclosed
EP-3283496-B1 RUTHENIUM- OR OSMIUM-BASED COMPLEX CATALYSTS ARLANXEO DEUTSCHLAND GMBH (DE) 2019-06-19 — — EP disclosed
US-20180290134-A1 RUTHENIUM-OR OSMIUM-BASED COMPLEX CATALYSTS ARLANXEO DEUTSCHLAND GMBH (DE) 2018-10-11 — — US disclosed
EP-3283496-A1 RUTHENIUM- OR OSMIUM-BASED COMPLEX CATALYSTS ARLANXEO Deutschland GmbH (DE) 2018-02-21 — — EP disclosed
WO-2016166097-A1 RUTHENIUM- OR OSMIUM-BASED COMPLEX CATALYSTS ARLANXEO DEUTSCHLAND GMBH (DE) 2016-10-20 — — WO disclosed
WO-2016166097-A1 RUTHENIUM- OR OSMIUM-BASED COMPLEX CATALYSTS ARLANXEO DEUTSCHLAND GMBH (DE) 2016-10-20 — — WO disclosed
EP-3081572-A1 RUTHENIUM-OR OSMIUM-BASED COMPLEX CATALYSTS ARLANXEO Deutschland GmbH (DE) 2016-10-19 — — EP disclosed
EP-3081572-A1 RUTHENIUM-OR OSMIUM-BASED COMPLEX CATALYSTS ARLANXEO Deutschland GmbH (DE) 2016-10-19 — — EP disclosed
US-8110636-B1 Multi-block sulfonated poly(phenylene) copolymer proton exchange membranes SANDIA CORPORATION (US) 2012-02-07 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10441948-B2 Ruthenium-or osmium-based complex catalysts OSTC, OSBP, OSBPL3 IRAK4 4064/4885ALDH1A1 1283/4885ACHE 1855/4885
US-20180290134-A1 RUTHENIUM-OR OSMIUM-BASED COMPLEX CATALYSTS OSTC, OSBP, OSBPL3 IRAK4 4064/4885ALDH1A1 1283/4885ACHE 1855/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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