SCHEMBL2563017

SCHEMBL2563017

CCOC(=O)c1ccc(CN2CC(c3ccc(OC(F)F)c4oc5ccccc5c34)CC2=O)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 3/20 0.58
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ALDH1A1 P00352 9/20 0.38
HPGD P15428 3/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
TNKS O95271 1/20 0.38
HTT P42858 1/20 0.38
LMNA P02545 1/20 0.37
RECQL P46063 1/20 0.36
MAPK10 P53779 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
KDM4E B2RXH2 3/20 0.35
PDE4B Q07343 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
PDE4A P27815 1/20 0.35
PDE4C Q08493 1/20 0.35
PDE4D Q08499 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL2561026 0.85 PDE10A (0.56) PDE10AKMT2AALDH1A1HPGDTSHR
SCHEMBL7711267 0.83 PDE10A (0.59) PDE10AHPGDTSHRPDE4BL3MBTL1
SCHEMBL2563219 0.83 PDE10A (0.63) PDE10APDE4BPDE4APDE4CPDE4D
SCHEMBL7703052 0.82 PDE10A (0.39) PDE10AMEN1KMT2AALDH1A1HPGD
SCHEMBL7703764 0.81 PDE10A (0.63) PDE10AHPGDTSHRPDE4BPDE4A
SCHEMBL2572379 0.81 PDE10A (0.63) PDE10APDE4BPDE4APDE4CPDE4D
SCHEMBL7710971 0.81 PDE10A (0.83) PDE10AHPGDTSHRPDE4BPDE4A
SCHEMBL7713587 0.80 PDE10A (0.67) PDE10AALDH1A1HPGDTSHRPDE4B
SCHEMBL2560675 0.80 PDE10A (0.50) PDE10AALDH1A1HPGDTSHRMAPK1
SCHEMBL2556919 0.79 PDE10A (0.51) PDE10AALDH1A1LMNAPDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011132051-A2 TRICYCLE COMPOUNDS AS PHOSPHODIESTERASE-10 INHIBITORS GLENMARK PHARMACEUTICALS S.A. (CH) 2011-10-27 WO disclosed