SCHEMBL2806319

SCHEMBL2806319

COCCCOc1cc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CCO2)C2CC2)ccc1OCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
REN P00797 9/20 0.53
NR1H4 Q96RI1 1/20 0.43
JAK2 O60674 1/20 0.40
JAK1 P23458 1/20 0.40
YAP1 P46937 2/20 0.39
PDE4B Q07343 1/20 0.39
TLR9 Q9NR96 2/20 0.38
TLR7 Q9NYK1 2/20 0.38
USP30 Q70CQ3 1/20 0.37
HSD17B10 Q99714 1/20 0.37
APP P05067 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
HPGD P15428 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL13131881 1.00 REN (0.53) RENNR1H4JAK2JAK1YAP1
SCHEMBL13169068 0.91 REN (0.56) RENNR1H4PDE4B
SCHEMBL2810181 0.91 REN (0.64) RENNR1H4PDE4B
SCHEMBL13131884 0.91 REN (0.64) RENNR1H4PDE4B
SCHEMBL2805889 0.88 REN (0.45) RENNR1H4JAK2JAK1YAP1
SCHEMBL18508872 0.87 REN (0.58) REN
SCHEMBL16471579 0.86 REN (0.68) REN
SCHEMBL15435856 0.86 REN (0.68) REN
SCHEMBL13131880 0.85 REN (0.66) RENNR1H4JAK2JAK1
SCHEMBL13132467 0.85 REN (0.48) RENNR1H4JAK2JAK1PDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2168952-B1 MORPHOLINE DERIVATIVES AS RENIN INHIBITORS MITSUBISHI TANABE PHARMA CORP (JP) 2017-02-15 EP disclosed
US-8975252-B2 Morpholine derivative SHANGHAI PHARMACEUTICALS HOLDING CO., LTD. (CN) 2015-03-10 US disclosed
US-8975252-B2 Morpholine derivative SHANGHAI PHARMACEUTICALS HOLDING CO., LTD. (CN) 2015-03-10 US disclosed
US-20100240644-A1 MORPHOLINE DERIVATIVE SHANGHAI PHARMACEUTICALS HOLDING CO., LTD. (CN) 2010-09-23 US disclosed
US-20100240644-A1 MORPHOLINE DERIVATIVE SHANGHAI PHARMACEUTICALS HOLDING CO., LTD. (CN) 2010-09-23 US disclosed
EP-2168952-A1 MORPHOLINE DERIVATIVE Mitsubishi Tanabe Pharma Corporation (JP) 2010-03-31 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 (1 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-20100240644-A1 MORPHOLINE DERIVATIVE REN, AGTR1, AGTR2 REN 1/4885NR1H4 574/4885JAK2 3246/4885

“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.