SCHEMBL2171745

SCHEMBL2171745

[CH2]C(C=CC)C=CCCC

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32
MEN1 O00255 1/20 0.31
CYP3A4 P08684 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL5209281 0.83 TSHR (0.33) TSHRMEN1CYP3A4KMT2A
SCHEMBL10767800 0.80
SCHEMBL4751225 0.79 MEN1 (0.50) TSHRMEN1CYP3A4KMT2A
SCHEMBL2122173 0.72
SCHEMBL2122168 0.72
SCHEMBL6325365 0.71 MEN1 (0.34) MEN1CYP3A4KMT2A
SCHEMBL28709594 0.71 MEN1 (0.57) TSHRMEN1CYP3A4KMT2A
SCHEMBL6325367 0.71 MEN1 (0.34) MEN1CYP3A4KMT2A
SCHEMBL7550121 0.70
SCHEMBL7550116 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111683930-B Novel isoxazole compound or salt thereof 日本欧爱特农业科技株式会社 2023-06-27 CN disclosed
US-20230130617-A1 PROCESS FOR IMPROVED OPIOID SYNTHESIS RHODES TECHNOLOGIES (US) 2023-04-27 US disclosed
CN-114096543-A Application of nucleoside analogue or combination preparation containing nucleoside analogue in resisting virus 中国科学院上海药物研究所 2022-02-25 CN disclosed
CN-110831923-A Polymer compositions stabilized with organic polysulfides 阿科玛股份有限公司 2020-02-21 CN disclosed
US-10316042-B2 Process for improved opioid synthesis RHODES TECHNOLOGIES (US) 2019-06-11 US disclosed
EP-2872516-B1 PROCESS FOR IMPROVED OPIOID SYNTHESIS RHODES TECH (US) 2017-08-30 EP disclosed
CN-102137668-B Pyrazolopyridine Derivatives as NADPH Oxidase Inhibitors GENKYOTEX S.A. (CH) 2016-05-18 CN disclosed
US-20150315203-A1 PROCESS FOR IMPROVED OPIOID SYNTHESIS RHODES TECHNOLOGIES 2015-11-05 US disclosed
EP-2872516-A1 PROCESS FOR IMPROVED OPIOID SYNTHESIS Rhodes Technologies (US) 2015-05-20 EP disclosed
WO-2014013313-A1 PROCESS FOR IMPROVED OPIOID SYNTHESIS RHODES TECHNOLOGIES (US) 2014-01-23 WO disclosed
EP-2348090-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT JNC Corporation (JP) 2011-07-27 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 (3 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-20150315203-A1 PROCESS FOR IMPROVED OPIOID SYNTHESIS OPRK1, OPRM1, OPRD1 TSHR 3155/4885MEN1 3876/4885CYP3A4 36/4885
US-10316042-B2 Process for improved opioid synthesis OPRK1, OPRM1, OPRD1 TSHR 3155/4885MEN1 3876/4885CYP3A4 36/4885
US-20230130617-A1 PROCESS FOR IMPROVED OPIOID SYNTHESIS OPRK1, OPRM1, OPRD1 TSHR 3276/4885MEN1 4481/4885CYP3A4 50/4885

“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.