SCHEMBL2805626

SCHEMBL2805626

COc1cc(CN(C(=O)OC(C)(C)C)C2CC2)cc2ccccc12

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
REN P00797 3/20 0.48
NR1H4 Q96RI1 1/20 0.45
BCHE P06276 1/20 0.42
HSD11B1 P28845 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
THRB P10828 1/20 0.41
SLC6A2 P23975 2/20 0.39
SLC6A4 P31645 2/20 0.39
SLC6A3 Q01959 2/20 0.39
CETP P11597 2/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.38
KCNH2 Q12809 1/20 0.38
MAPK14 Q16539 1/20 0.38

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
SCHEMBL2813384 0.89 REN (0.62) RENNR1H4BCHEHSD11B1SLC6A2
SCHEMBL12525524 0.88 REN (0.47) RENNR1H4BCHEHSD11B1LMNA
SCHEMBL3123190 0.87 REN (0.51) RENNR1H4BCHEHSD11B1LMNA
SCHEMBL2808373 0.87 BCHE (0.45) RENNR1H4BCHEHSD11B1LMNA
SCHEMBL13132256 0.85 REN (0.49) RENNR1H4BCHEHSD11B1CETP
SCHEMBL2808495 0.83 KDM4E (0.52) RENNR1H4BCHEHSD11B1LMNA
SCHEMBL2812155 0.83 REN (0.48) RENNR1H4BCHEHSD11B1SLC6A2
SCHEMBL13132503 0.79 REN (0.53) RENNR1H4HSD11B1
SCHEMBL15418020 0.75 REN (0.59) REN
SCHEMBL2814031 0.75 REN (0.64) RENNR1H4LMNAMAPTTHRB

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 7 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-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
US-20100240644-A1 MORPHOLINE DERIVATIVE SHANGHAI PHARMACEUTICALS HOLDING CO., LTD. (CN) 2010-09-23 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 (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 574/4885BCHE 1305/4885

“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.