SCHEMBL15923558

SCHEMBL15923558

CC(CB1OC(C)(C)C(C)(C)O1)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.45
LAP3 P28838 1/20 0.45
TAAR1 Q96RJ0 5/20 0.44
AOC3 Q16853 2/20 0.40
TRPA1 O75762 5/20 0.39
RIPK1 Q13546 1/20 0.39
LPL P06858 1/20 0.38
LIPG Q9Y5X9 1/20 0.38
ALDH1A1 P00352 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
SCHEMBL28304787 1.00 ANPEP (0.45) ANPEPLAP3TAAR1AOC3TRPA1
SCHEMBL28304747 0.84 ACHE (0.39) ANPEPLAP3
SCHEMBL28304746 0.84 ACHE (0.39) ANPEPLAP3
SCHEMBL28002790 0.82 C3AR1 (0.39) ANPEPLAP3AOC3
SCHEMBL28002524 0.82 PYCR1 (0.36) ANPEPLAP3
SCHEMBL28002804 0.82 LPL (0.42) ANPEPLAP3AOC3LPLLIPG
SCHEMBL28002801 0.82 LPL (0.42) ANPEPLAP3AOC3LPLLIPG
SCHEMBL28305843 0.82 ANPEP (0.33) ANPEPLAP3
SCHEMBL28002526 0.82 PYCR1 (0.36) ANPEPLAP3
SCHEMBL28305842 0.82 ANPEP (0.33) ANPEPLAP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116622017-A Chiral oxazoline imine pyridine functionalized porous organic polymer and preparation and application thereof 浙江工业大学 2023-08-22 CN disclosed
CN-105294667-B NNN ligand, its metal complex, preparation method and application 中国科学院上海有机化学研究所 2019-06-28 CN disclosed
US-10112961-B2 Hydroboration and borylation with cobalt catalysts THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2018-10-30 US disclosed
US-20160297838-A1 HYDROBORATION AND BORYLATION WITH COBALT CATALYSTS THE TRUSTEES OF PRINCETON UNIVERSITY 2016-10-13 US disclosed
US-20160297838-A1 HYDROBORATION AND BORYLATION WITH COBALT CATALYSTS THE TRUSTEES OF PRINCETON UNIVERSITY 2016-10-13 US disclosed
US-20160297838-A1 HYDROBORATION AND BORYLATION WITH COBALT CATALYSTS THE TRUSTEES OF PRINCETON UNIVERSITY 2016-10-13 US disclosed
EP-3071552-A1 HYDROBORATION AND BORYLATION WITH COBALT CATALYSTS The Trustees of Princeton University (US) 2016-09-28 EP disclosed
CN-105294667-A NNN ligand, metal complexes thereof, preparation methods and application SHANGHAI INSITITUTE OF ORGANIC CHEMISTRY CHINESE ACADEMY OF SCIENCES 2016-02-03 CN disclosed
WO-2015077344-A1 HYDROBORATION AND BORYLATION WITH COBALT CATALYSTS THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2015-05-28 WO disclosed
WO-2014117752-A1 PNN LIGAND-METAL COMPLEX CATALYST, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF 中国科学院上海有机化学研究所 (CN) 2014-08-07 WO 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-10112961-B2 Hydroboration and borylation with cobalt catalysts SLC9B2, SLC9A3, SLC9A2 ANPEP 4048/4885LAP3 2366/4885TAAR1 2679/4885
US-20160297838-A1 HYDROBORATION AND BORYLATION WITH COBALT CATALYSTS SLC9B2, SLC9A3, SLC9A2 ANPEP 4048/4885LAP3 2366/4885TAAR1 2679/4885

“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.