SCHEMBL2932910

SCHEMBL2932910

N#Cc1ccc(NC[C@@H]2CNC[C@@H]2Cc2ccccc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 2/20 0.43
KMT2A Q03164 1/20 0.42
REN P00797 7/20 0.40
CTSD P07339 2/20 0.40
CTSE P14091 2/20 0.40
PGC P20142 2/20 0.40
MAOB P27338 3/20 0.37
RORC P51449 1/20 0.37
MAOA P21397 2/20 0.36
ABCB1 P08183 1/20 0.36
ABCG2 Q9UNQ0 1/20 0.36
CCR3 P51677 1/20 0.36
KDM1A O60341 1/20 0.36

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
SCHEMBL2937708 0.86 GBA1 (0.53) GBA1RENCTSDCTSEPGC
SCHEMBL2936937 0.82 REN (0.58) GBA1KMT2ARENCTSDCTSE
SCHEMBL2931636 0.81 MEN1 (0.48) GBA1KMT2AMAOB
SCHEMBL2932905 0.80 CCR3 (0.52) GBA1KMT2AMAOACCR3
SCHEMBL2936677 0.80 GBA1 (0.44) GBA1KMT2ARENCTSDCTSE
SCHEMBL8223739 0.72 GBA1 (0.54) GBA1RENCTSDCTSEPGC
SCHEMBL3910632 0.72 GBA1 (0.54) GBA1RENCTSDCTSEPGC
SCHEMBL8228607 0.71 HTR2C (0.53) GBA1KMT2ARENCTSDCTSE
SCHEMBL3613536 0.71 ACHE (0.46) GBA1RENCTSDCTSEPGC
SCHEMBL2932964 0.71 REN (0.61) GBA1RENCTSDCTSEPGC

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 6 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
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

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 GBA1 1130/4885KMT2A 3722/4885REN 1/4885

“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.