SCHEMBL2807712

SCHEMBL2807712

COCCCOc1cc(CN(C(=O)OC(C)(C)C)C2CC2)c(Br)c2ccccc12

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
REN P00797 15/20 0.42
NR1H4 Q96RI1 1/20 0.37
MC4R P32245 1/20 0.36
MC5R P33032 1/20 0.36
MC3R P41968 1/20 0.36
ALDH1A1 P00352 1/20 0.35
HSD11B1 P28845 1/20 0.34
PTGDR2 Q9Y5Y4 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
SCHEMBL2811860 0.89 REN (0.45) RENNR1H4ALDH1A1
SCHEMBL13132103 0.87 REN (0.43) RENNR1H4HSD11B1
SCHEMBL2807863 0.84 REN (0.39) RENNR1H4
SCHEMBL13132102 0.83 REN (0.39) RENNR1H4
SCHEMBL13132101 0.83 REN (0.39) RENNR1H4
SCHEMBL13132099 0.82 REN (0.40) RENNR1H4
SCHEMBL13132105 0.82 REN (0.40) RENNR1H4
SCHEMBL18508693 0.82 REN (0.44) REN
SCHEMBL13132100 0.82 REN (0.40) RENNR1H4ALDH1A1
SCHEMBL2813384 0.82 REN (0.62) RENNR1H4HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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 574/4885MC4R 185/4885

“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.