Pyrrolidine

Pyrrolidine

SCHEMBL4724680

C1CCNC1.Clc1ccc2nc[nH]c2c1

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 1/20 0.47
PARP1 P09874 1/20 0.46
KDM4E B2RXH2 1/20 0.46
MAPT P10636 1/20 0.46
RAD52 P43351 1/20 0.46
CYP26A1 O43174 1/20 0.44
MMP12 P39900 1/20 0.44
LMNA P02545 2/20 0.43
MAT2A P31153 1/20 0.43
POLB P06746 2/20 0.43
ALDH1A1 P00352 1/20 0.42
CYP3A4 P08684 1/20 0.42
NAMPT P43490 1/20 0.42
XDH P47989 1/20 0.42
PSMD14 O00487 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
QPCT Q16769 4/20 0.41
P2RY14 Q15391 1/20 0.41
L3MBTL1 Q9Y468 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
SCHEMBL1445055 0.88 PRKCI (0.59) PRKCIPARP1KDM4EMAPTRAD52
SCHEMBL30544126 0.88 PRKCI (0.59) PRKCIPARP1KDM4EMAPTRAD52
SCHEMBL11404862 0.86 PRKCI (0.57) PRKCIPARP1KDM4EMAPTRAD52
SCHEMBL8817622 0.81 PRKCI (0.52) PRKCIPARP1KDM4EMAPTRAD52
Pyrrolidine SCHEMBL4769098 0.80 QPCT (0.48) PRKCIPARP1KDM4EMAPTRAD52
Pyrrolidine SCHEMBL4768471 0.80 QPCT (0.48) PRKCIPARP1KDM4EMAPTRAD52
Piperidine SCHEMBL4766187 0.79 QPCT (0.47) PRKCIPARP1KDM4EMAPTRAD52
Piperidine SCHEMBL4724630 0.79 QPCT (0.47) PRKCIPARP1KDM4EMAPTRAD52
Benzimidazole SCHEMBL4553022 0.75 SMN1; SMN2 (0.40) PRKCIPARP1KDM4EMAPTRAD52
Imidazole SCHEMBL3397308 0.74 PRKCI (0.45) PRKCIPARP1KDM4EMAPTRAD52

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1994022-A2 N-SUBSTITUTED-AZACYCLYLAMINES AS HISTAMINE-3 ANTAGONISTS Wyeth a Corporation of the State of Delaware (US) 2008-11-26 EP disclosed
WO-2007108936-A2 N-SUBSTITUTED-AZACYCLYLAMINES AS HISTAMINE-3 ANTAGONISTS WYETH (US) 2007-09-27 WO disclosed