SCHEMBL8264382

SCHEMBL8264382

COc1cc(N(Cc2ccccc2)C[C@H]2CNCC2c2cccc(C(C)C)c2)ccc1Cl

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
REN P00797 13/20 0.45
SLC6A2 P23975 2/20 0.35
SLC6A4 P31645 2/20 0.35
SLC6A3 Q01959 2/20 0.35
LTC4S Q16873 1/20 0.34
HTR1A P08908 1/20 0.33
ADRA1D P25100 1/20 0.33
HTR2A P28223 1/20 0.33
ADRA1A P35348 1/20 0.33
ADRA1B P35368 1/20 0.33
HTR2B P41595 1/20 0.33
KCNH2 Q12809 1/20 0.33
S1PR1 P21453 1/20 0.33
ROCK2 O75116 1/20 0.33

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
SCHEMBL2929371 1.00 REN (0.45) RENSLC6A2SLC6A4SLC6A3LTC4S
SCHEMBL2929370 1.00 REN (0.45) RENSLC6A2SLC6A4SLC6A3LTC4S
SCHEMBL2930718 0.87 REN (0.40) RENLTC4SHTR1AHTR2AHTR2B
SCHEMBL2930717 0.87 REN (0.40) RENLTC4SHTR1AHTR2AHTR2B
SCHEMBL13404498 0.87 REN (0.40) RENLTC4SHTR1AHTR2AHTR2B
SCHEMBL2929489 0.86 REN (0.59) RENSLC6A2SLC6A4SLC6A3ROCK2
SCHEMBL8263380 0.86 REN (0.59) RENSLC6A2SLC6A4SLC6A3ROCK2
SCHEMBL2929491 0.86 REN (0.59) RENSLC6A2SLC6A4SLC6A3ROCK2
SCHEMBL5280302 0.75 PDE4A (0.36) SLC6A2SLC6A4SLC6A3ROCK2
SCHEMBL8261947 0.75 REN (0.54) RENSLC6A2SLC6A4SLC6A3ROCK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100087427-A1 PYRROLIDINE DERIVATIVES FOR THE TREATMENT OF A DISEASE DEPENDING ON THE ACTIVITY OF RENIN BREITENSTEIN WERNER 2010-04-08 US disclosed
US-20100087427-A1 PYRROLIDINE DERIVATIVES FOR THE TREATMENT OF A DISEASE DEPENDING ON THE ACTIVITY OF RENIN BREITENSTEIN WERNER 2010-04-08 US disclosed
WO-2006066896-A2 PYRROLIDINE DERIVATIVES FOR THE TREATMENT OF A DISEASE DEPENDING ON THE ACTIVITY OF RENIN NOVARTIS AG (CH) 2006-06-29 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 (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-20100087427-A1 PYRROLIDINE DERIVATIVES FOR THE TREATMENT OF A DISEASE DEPENDING ON THE ACTIVITY OF RENIN REN, ACE, PEPD REN 1/4885SLC6A2 472/4885SLC6A4 1057/4885

“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.