SCHEMBL6446892

SCHEMBL6446892

CN(C)CCCCCCCl

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.69
ALDH1A1 P00352 4/20 0.69
DNM1 Q05193 3/20 0.55
MAPT P10636 1/20 0.40
SIGMAR1 Q99720 2/20 0.39
LMNA P02545 1/20 0.38
TP53 P04637 1/20 0.38
HTT P42858 1/20 0.38
HBB P68871 1/20 0.38
KDM4E B2RXH2 1/20 0.37
TDP1 Q9NUW8 3/20 0.35
CA12 O43570 1/20 0.35
CA2 P00918 1/20 0.35
CA3 P07451 1/20 0.35
CA4 P22748 1/20 0.35
CA6 P23280 1/20 0.35
CA5A P35218 1/20 0.35
CA7 P43166 1/20 0.35
CA9 Q16790 1/20 0.35
CA14 Q9ULX7 1/20 0.35

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
SCHEMBL9569803 1.00 TSHR (0.69) TSHRALDH1A1DNM1MAPTSIGMAR1
SCHEMBL29165133 1.00 TSHR (0.69) TSHRALDH1A1DNM1MAPTSIGMAR1
SCHEMBL31154544 1.00 TSHR (0.69) TSHRALDH1A1DNM1MAPTSIGMAR1
SCHEMBL6443829 1.00
Hydrochloric Acid SCHEMBL29063477 0.97 ALDH1A1 (0.65) TSHRALDH1A1DNM1MAPTSIGMAR1
Hydrochloric Acid SCHEMBL29063506 0.97 ALDH1A1 (0.65) TSHRALDH1A1DNM1MAPTSIGMAR1
Hydrochloric Acid SCHEMBL29063587 0.97 ALDH1A1 (0.65) TSHRALDH1A1DNM1MAPTSIGMAR1
Hydrochloric Acid SCHEMBL10478935 0.97 ALDH1A1 (0.65) TSHRALDH1A1DNM1MAPTSIGMAR1
Hydrochloric Acid SCHEMBL29063593 0.97 ALDH1A1 (0.65) TSHRALDH1A1DNM1MAPTSIGMAR1
SCHEMBL6187154 0.97

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3750894-B1 UREA-SUBSTITUTED AROMATIC RING-LINKED DIOXAZOLINE COMPOUND, PREPARATION METHOD THEREFOR, AND USES THEREOF BEIJING SCITECH MQ PHARMACEUTICALS LTD (CN) 2024-04-03 EP disclosed
US-11479559-B2 Urea-substituted aromatic ring-linked dioxinoquinoline compounds, preparation method and uses thereof BEIJING SCITECH-MQ PHARMACEUTICALS LIMITED (CN) 2022-10-25 US disclosed
US-20200399284-A1 UREA-SUBSTITUTED AROMATIC RING-LINKED DIOXINOQUINOLINE COMPOUNDS, PREPARATION METHOD AND USES THEREOF BEIJING SCITECH-MQ PHARMACEUTICALS LIMITED (CN) 2020-12-24 US disclosed
EP-3750894-A1 UREA-SUBSTITUTED AROMATIC RING-LINKED DIOXAZOLINE COMPOUND, PREPARATION METHOD THEREFOR, AND USES THEREOF Beijing Scitech-MQ Pharmaceuticals Limited (CN) 2020-12-16 EP disclosed
WO-2020042972-A1 UREA-SUBSTITUTED AROMATIC RING-LINKED DIOXANE AND QUINAZOLINE OR QUINOLINE COMPOUND, COMPOSITION AND APPLICATION THEREOF 北京赛特明强医药科技有限公司 2020-03-05 WO disclosed
CN-110667199-A High-flame-retardance breathable anti-static fabric 深圳市大毛牛新材料科技有限公司 2020-01-10 CN disclosed
US-6858679-B2 Compositions providing improved functionalization of terminal anions and processes for improved functionalization of terminal anions FMC CORPORATION (US) 2005-02-22 US disclosed
US-20030153693-A1 Compositions providing improved functionalization of terminal anions and processes for improved functionalization of terminal anions QUIRK RODERIC PAUL (US) 2003-08-14 US disclosed
US-6605564-B1 Anionic polymerization initiators and salt additives selected from sodium chloride, sodium iodide, potassium chloride, potassium t-butoxide, for increasing the efficiency of reactions between living polymer anions and electrophiles FMC CORPORATION 2003-08-12 US disclosed
US-6545103-B2 Living polymers FMC CORPORATION 2003-04-08 US disclosed
US-20020010082-A1 Compositions providing improved functionalization of terminal anions and processes for improved functionalization of terminal anions FMC CORPORATION 2002-01-24 US disclosed
EP-0359547-B1 Pyridine compounds and pharmaceutical use thereof YOSHITOMI PHARMACEUTICAL (JP) 1996-01-24 EP disclosed
EP-0558094-A1 Pyridine compounds for treating amnesia YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1993-09-01 EP disclosed
US-5001137-A Pyridine compounds and pharmaceutical use thereof YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1991-03-19 US disclosed
EP-0359547-A1 Pyridine compounds and pharmaceutical use thereof YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1990-03-21 EP 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-20200399284-A1 UREA-SUBSTITUTED AROMATIC RING-LINKED DIOXINOQUINOLINE COMPOUNDS, PREPARATION METHOD AND USES THEREOF RET, BRAF, RAF1 TSHR 674/4885ALDH1A1 805/4885DNM1 3867/4885
US-11479559-B2 Urea-substituted aromatic ring-linked dioxinoquinoline compounds, preparation method and uses thereof RET, BRAF, RAF1 TSHR 674/4885ALDH1A1 805/4885DNM1 3867/4885

“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.