SCHEMBL5056015

SCHEMBL5056015

CCCC1CCN(Cc2cc(C)nc3c2ncn3Cc2ccc(OC)cc2)C1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.45
PDE2A O00408 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CTSL P07711 2/20 0.39
ADORA2A P29274 1/20 0.39
PDGFRA P16234 1/20 0.38
CCNE1 P24864 1/20 0.38
CDK2 P24941 1/20 0.38
HPGD P15428 1/20 0.37
CXCR4 P61073 1/20 0.36
HSP90AA1 P07900 1/20 0.36
HSP90AB1 P08238 1/20 0.36
HTR1A P08908 1/20 0.36
SLC6A4 P31645 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
NPY1R P25929 1/20 0.36
YTHDC1 Q96MU7 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
SCHEMBL5056987 0.87 CNR2 (0.42) CNR2CTSLADORA2APDGFRACCNE1
SCHEMBL5062614 0.81 NR3C1 (0.43) CNR2MEN1KMT2AL3MBTL1HPGD
SCHEMBL5053342 0.81 CNR2 (0.43) CNR2MEN1KMT2AL3MBTL1CTSL
SCHEMBL1665638 0.76 MEN1 (0.50) CNR2MEN1KMT2AL3MBTL1CTSL
SCHEMBL5055466 0.76 HPGD (0.42) CNR2CTSLHPGD
SCHEMBL5053350 0.76 PDE10A (0.44) PDE2ACXCR4
SCHEMBL5062834 0.72 TLR7 (0.41) CNR2L3MBTL1HPGDCXCR4ALDH1A1
SCHEMBL1664866 0.71 CNR2 (0.40) CNR2MEN1KMT2AL3MBTL1CTSL
SCHEMBL1665092 0.71 CTSL (0.39) CNR2CTSLADORA2APDGFRACCNE1
SCHEMBL3705572 0.70 MEN1 (0.59) MEN1KMT2A

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-1912966-A2 2-OXO-1-PYRROLIDINE DERIVATIVES AND THEIR THERAPEUTIC USE ON THE CENTRAL NERVOUS SYSTEM UCB, S.A. (BE) 2008-04-23 EP disclosed
EP-1891042-A2 2-OXO-1-PYRROLIDINE DERIVATIVES, PROCESSES FOR PREPARING THEM AND THEIR THERAPEUTIC USE ON THE CENTRAL NERVOUS SYSTEM UCB Pharma, S.A. (BE) 2008-02-27 EP disclosed
WO-2006128692-A2 2-OXO-1-PYRROLIDINE DERIVATIVES AND THEIR THERAPEUTIC USE ON THE CENTRAL NERVOUS SYSTEM UCB PHARMA, S.A. (BE) 2006-12-07 WO disclosed
WO-2006128693-A2 2 -OXO-I -PYRROLIDINE DERIVATIVES/ PROCESSES FOR PREPARING THEM AND THEIR THERAPEUTIC USE ON THE CENTRAL NERVOUS SYSTEM UCB PHARMA, S.A. (BE) 2006-12-07 WO disclosed