SCHEMBL27487665

SCHEMBL27487665

O=CC1NCC(CCOC(=O)c2ccccc2)(c2ccc(F)c(F)c2)O1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.35
TDP1 Q9NUW8 1/20 0.34
PLA2G7 Q13093 1/20 0.34
LMNA P02545 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C19 P33261 1/20 0.32
POLB P06746 1/20 0.32
GAA P10253 1/20 0.32
MAPK1 P28482 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
TACR2 P21452 1/20 0.32
ALDH1A1 P00352 1/20 0.31
DPP4 P27487 1/20 0.31
PPM1B O75688 1/20 0.31

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
SCHEMBL27466284 0.86 SLC6A2 (0.37) TDP1LMNAMEN1KMT2ACYP1A2
SCHEMBL4630047 0.78 TDP1 (0.37) BACE1TDP1PLA2G7LMNAMEN1
SCHEMBL4630553 0.77 TACR2 (0.37) BACE1TDP1PLA2G7LMNATACR2
SCHEMBL4630747 0.77 TDP1 (0.36) BACE1TDP1PLA2G7LMNAMEN1
SCHEMBL4631282 0.71 TACR2 (0.58) TDP1TACR2ALDH1A1
SCHEMBL27390996 0.70 TACR2 (0.45) LMNACYP1A2POLBMAPK1TACR2
SCHEMBL4630746 0.69 TACR2 (0.36) TDP1LMNAKMT2APOLBTACR2
SCHEMBL4630781 0.65 SLC6A2 (0.40) TDP1LMNATACR2
SCHEMBL7482580 0.64 TDP1 (0.42) BACE1TDP1LMNAKMT2AGAA
SCHEMBL8153966 0.64 TDP1 (0.42) BACE1TDP1LMNAKMT2AGAA

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
CN-1821241-A Substituted heterocyclic compounds, preparation method therefor and pharmaceutical compositions containing same SANOFI SA (FR) 2006-08-23 CN disclosed
CN-1636983-A Substituted heterocyclic compounds SANOFI AVENTIS (FR) 2005-07-13 CN disclosed
CN-1202093-C Substituted heterocyclic compounds SANOFI AVENTIS (FR) 2005-05-18 CN disclosed
CN-1179954-C Substituted heterocyclic compounds, process for their preparation and pharmaceutical compositions containing them ��ŵ�Ѻϳ�ʵ���� 2004-12-15 CN disclosed
CN-1502612-A Substituted heterocyclic compounds, process for their preparation and pharmaceutical compositions containing them ��ŵ�Ѻϳ�ʵ���� 2004-06-09 CN disclosed
CN-1321639-A Substituted heterocyclic compounds, process for their preparation and pharmaceutical compositions containing them SANOFI SYNTHESIZING LAB (FR) 2001-11-14 CN disclosed