SCHEMBL2932962

SCHEMBL2932962

Clc1ccc(CNC[C@@H]2CNC[C@@H]2Cc2ccccc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
REN P00797 8/20 0.56
CTSD P07339 2/20 0.56
CTSE P14091 2/20 0.56
PGC P20142 2/20 0.56
HTR2C P28335 1/20 0.46
GBA1 P04062 1/20 0.46
HRH3 Q9Y5N1 2/20 0.44
HRH4 Q9H3N8 2/20 0.44
MAN1B1 Q9UKM7 1/20 0.42
CACNA1G O43497 1/20 0.41
KMT2A Q03164 1/20 0.41
CXCR4 P61073 1/20 0.41

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
SCHEMBL8228607 0.91 HTR2C (0.53) RENCTSDCTSEPGCHTR2C
SCHEMBL2936937 0.82 REN (0.58) RENCTSDCTSEPGCGBA1
SCHEMBL3609134 0.77 REN (0.53) RENCTSDCTSEPGCGBA1
SCHEMBL2932961 0.77 REN (0.53) RENCTSDCTSEPGCGBA1
SCHEMBL8223739 0.77 GBA1 (0.54) RENCTSDCTSEPGCHTR2C
SCHEMBL3910632 0.77 GBA1 (0.54) RENCTSDCTSEPGCHTR2C
SCHEMBL8223341 0.77 GBA1 (0.54) RENCTSDCTSEPGCGBA1
SCHEMBL3919455 0.77 GBA1 (0.54) RENCTSDCTSEPGCGBA1
SCHEMBL3610820 0.76 REN (0.51) RENCTSDCTSEPGCGBA1
SCHEMBL14498489 0.74 HTR2C (0.67) HTR2CGBA1MAN1B1KMT2ACXCR4

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 7 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 claimed
US-20100087427-A1 PYRROLIDINE DERIVATIVES FOR THE TREATMENT OF A DISEASE DEPENDING ON THE ACTIVITY OF RENIN BREITENSTEIN WERNER 2010-04-08 US claimed
EP-1836163-A2 PYRROLIDINE DERIVATIVES FOR THE TREATMENT OF A DISEASE DEPENDING ON THE ACTIVITY OF RENIN Novartis AG (CH) 2007-09-26 EP claimed
WO-2006066896-A2 PYRROLIDINE DERIVATIVES FOR THE TREATMENT OF A DISEASE DEPENDING ON THE ACTIVITY OF RENIN NOVARTIS AG (CH) 2006-06-29 WO claimed
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 1/4885CTSD 153/4885CTSE 598/4885

“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.