SCHEMBL8263380

SCHEMBL8263380

CC(C)c1cccc(C2CNC[C@@H]2CN(Cc2ccccc2)c2ccc(Cl)cc2)c1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
REN P00797 11/20 0.59
SLC6A2 P23975 5/20 0.49
SLC6A4 P31645 5/20 0.49
SLC6A3 Q01959 5/20 0.49
CTSD P07339 2/20 0.43
CTSE P14091 2/20 0.43
PGC P20142 2/20 0.43
ROCK2 O75116 1/20 0.35
CNR2 P34972 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
CNR1 P21554 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
SCHEMBL2929489 1.00 REN (0.59) RENSLC6A2SLC6A4SLC6A3CTSD
SCHEMBL2929491 1.00 REN (0.59) RENSLC6A2SLC6A4SLC6A3CTSD
SCHEMBL2929371 0.86 REN (0.45) RENSLC6A2SLC6A4SLC6A3ROCK2
SCHEMBL2929370 0.86 REN (0.45) RENSLC6A2SLC6A4SLC6A3ROCK2
SCHEMBL8264382 0.86 REN (0.45) RENSLC6A2SLC6A4SLC6A3ROCK2
SCHEMBL13177235 0.86 REN (0.74) RENSLC6A2SLC6A4SLC6A3CTSD
SCHEMBL2934664 0.86 REN (0.74) RENSLC6A2SLC6A4SLC6A3CTSD
SCHEMBL2934662 0.86 REN (0.74) RENSLC6A2SLC6A4SLC6A3CTSD
SCHEMBL2936881 0.86 REN (0.54) RENSLC6A2SLC6A4SLC6A3CTSD
SCHEMBL8261947 0.86 REN (0.54) RENSLC6A2SLC6A4SLC6A3CTSD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1836163-B1 PYRROLIDINE DERIVATIVES FOR THE TREATMENT OF A DISEASE DEPENDING ON THE ACTIVITY OF RENIN NOVARTIS AG (CH) 2010-09-22 EP 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
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.