SCHEMBL2936771

SCHEMBL2936771

CC(C)(C)OC(=O)N1C[C@H](CN(Cc2cccc(C#N)c2)c2ccc(Cl)cc2)[C@@H](Cc2ccccc2)C1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
REN P00797 4/20 0.43
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
MGLL Q99685 1/20 0.39
KDM1A O60341 3/20 0.39
PGR P06401 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
MDM2 Q00987 1/20 0.38
JAK2 O60674 1/20 0.36
JAK1 P23458 1/20 0.36
CCR5 P51681 5/20 0.36
STS P08842 1/20 0.36
KCNK3 O14649 1/20 0.36
KCNK9 Q9NPC2 1/20 0.36
CNR1 P21554 1/20 0.35

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
SCHEMBL2932171 1.00 REN (0.43) RENMEN1KMT2AMGLLKDM1A
SCHEMBL2932172 1.00 REN (0.43) RENMEN1KMT2AMGLLKDM1A
SCHEMBL2932387 0.88 REN (0.46) RENMEN1KMT2AJAK2JAK1
SCHEMBL3611195 0.88 REN (0.46) RENMEN1KMT2AJAK2JAK1
SCHEMBL2932386 0.88 REN (0.46) RENMEN1KMT2AJAK2JAK1
SCHEMBL8263139 0.88 REN (0.45) RENMEN1KMT2AJAK2JAK1
SCHEMBL2930620 0.88 REN (0.45) RENMEN1KMT2AJAK2JAK1
SCHEMBL2936409 0.88 REN (0.45) RENMEN1KMT2AJAK2JAK1
SCHEMBL2938751 0.88 REN (0.45) RENMEN1KMT2AJAK2JAK1
SCHEMBL2936411 0.88 REN (0.45) RENMEN1KMT2AJAK2JAK1

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
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
EP-1836163-A2 PYRROLIDINE DERIVATIVES FOR THE TREATMENT OF A DISEASE DEPENDING ON THE ACTIVITY OF RENIN Novartis AG (CH) 2007-09-26 EP 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 1/4885MEN1 1437/4885KMT2A 3722/4885

“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.