SCHEMBL17013296

SCHEMBL17013296

COC(=O)NCCCn1cc(C(C)NC2CC2)nc1-c1ccc(C(F)(F)F)cc1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TEAD1 P28347 2/20 0.38
ALOX5 P09917 8/20 0.37
EPHX2 P34913 8/20 0.37
TRPV1 Q8NER1 3/20 0.36
TRPV4 Q9HBA0 1/20 0.36
CCR5 P51681 2/20 0.34
REN P00797 1/20 0.34
CXCR2 P25025 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
SCHEMBL17013348 0.90 MAPT (0.36) REN
SCHEMBL15599789 0.90 LMNA (0.37) REN
SCHEMBL17013306 0.88 GAA (0.37)
SCHEMBL17013300 0.88 REN (0.36) TRPV4REN
SCHEMBL17013352 0.84 REN (0.38) REN
SCHEMBL17013309 0.84 TDP1 (0.40) REN
SCHEMBL17013299 0.83 NPC1 (0.37) REN
SCHEMBL17013305 0.82 AVPR1B (0.42)
SCHEMBL17013298 0.81 MC4R (0.37) REN
SCHEMBL17013310 0.81 SMYD2 (0.38) REN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9556159-B2 Renin inhibitor MITSUBISHI TANABE PHARMA CORPORATION (JP) 2017-01-31 US disclosed
US-9556159-B2 Renin inhibitor MITSUBISHI TANABE PHARMA CORPORATION (JP) 2017-01-31 US disclosed
EP-2933248-A1 NOVEL RENIN INHIBITOR Mitsubishi Tanabe Pharma Corporation (JP) 2015-10-21 EP disclosed
US-20150232459-A1 NOVEL RENIN INHIBITOR SHANGHAI PHARMACEUTICALS HOLDING CO., LTD. (CN) 2015-08-20 US disclosed
US-20150232459-A1 NOVEL RENIN INHIBITOR SHANGHAI PHARMACEUTICALS HOLDING CO., LTD. (CN) 2015-08-20 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-20150232459-A1 NOVEL RENIN INHIBITOR REN, AGTR1, ACE TEAD1 4099/4885ALOX5 2274/4885EPHX2 1510/4885

“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.