SCHEMBL4052799

SCHEMBL4052799

NC1CCN(C(=O)c2ccc(Cl)c(Cl)c2)CC1

nearest known ligand 0.69

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.69
PKM P14618 1/20 0.63
HSD11B1 P28845 1/20 0.63
TSHR P16473 1/20 0.60
LRRK2 Q5S007 1/20 0.54
UBE2M P61081 1/20 0.53
DCUN1D1 Q96GG9 1/20 0.53
MGLL Q99685 1/20 0.52
CCR3 P51677 1/20 0.49
KMT2A Q03164 1/20 0.49

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
SCHEMBL14275541 0.91 HPGD (0.60) HPGDPKMHSD11B1TSHRLRRK2
SCHEMBL6279698 0.89 HPGD (0.71) HPGDPKMHSD11B1TSHRLRRK2
SCHEMBL3454519 0.84 HPGD (0.69) HPGDPKMHSD11B1TSHRUBE2M
SCHEMBL17615024 0.84 HPGD (0.49) HPGDPKMHSD11B1TSHRLRRK2
SCHEMBL7299547 0.83 MAPT (0.70) HPGDPKMHSD11B1TSHRUBE2M
SCHEMBL1136719 0.83 L3MBTL3 (0.59) HPGDHSD11B1MGLLKMT2A
SCHEMBL647507 0.82 MGLL (0.69) HPGDHSD11B1MGLLKMT2A
Hydrochloric Acid SCHEMBL1136918 0.81 L3MBTL3 (0.58) HPGDHSD11B1MGLLKMT2A
Bromide SCHEMBL1136932 0.81 L3MBTL3 (0.58) HPGDHSD11B1MGLLKMT2A
SCHEMBL13202935 0.81 HPGD (0.63) HPGDPKMHSD11B1TSHRUBE2M

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
WO-2009106561-A1 PYRAZINE COMPOUNDS FOR TREATING GPR119 RELATED DISORDERS BIOVITRUM AB (PUBL) (SE) 2009-09-03 WO disclosed
WO-2009106561-A1 PYRAZINE COMPOUNDS FOR TREATING GPR119 RELATED DISORDERS BIOVITRUM AB (PUBL) (SE) 2009-09-03 WO disclosed