SCHEMBL7749585

SCHEMBL7749585

CN(C)CCc1ccc2ccccc2n1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 8/20 0.51
NCF1 P14598 1/20 0.50
CYP1A2 P05177 3/20 0.47
CYSLTR2 Q9NS75 1/20 0.47
CYSLTR1 Q9Y271 1/20 0.47
TAAR1 Q96RJ0 1/20 0.45
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
LMNA P02545 1/20 0.43

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
SCHEMBL2913941 0.83 PDE10A (0.61) PDE10ANCF1CYP1A2CYSLTR2CYSLTR1
SCHEMBL12468389 0.82 NCF1 (0.52) PDE10ANCF1CYP1A2CYSLTR2CYSLTR1
SCHEMBL28215162 0.81 PDE10A (0.49) PDE10ANCF1CYP1A2CYSLTR2CYSLTR1
SCHEMBL725176 0.80 PDE10A (0.54) PDE10ACYP1A2CYSLTR2CYSLTR1
SCHEMBL5025561 0.80 PDE10A (0.50) PDE10ANCF1CYP1A2CYSLTR2CYSLTR1
SCHEMBL6798820 0.79 CYSLTR2 (0.53) PDE10ANCF1CYP1A2CYSLTR2CYSLTR1
SCHEMBL24943586 0.78 NCF1 (0.52) PDE10ANCF1CYP1A2CYSLTR2CYSLTR1
SCHEMBL29047068 0.78 PDE10A (0.53) PDE10ACYP1A2CYSLTR2CYSLTR1
Iodide SCHEMBL1343671 0.78 PDE10A (0.53) PDE10ACYP1A2CYSLTR2CYSLTR1
SCHEMBL2334595 0.78 CYSLTR2 (0.52) PDE10ANCF1CYP1A2CYSLTR2CYSLTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1069901-A4 CALCILYTIC COMPOUNDS AND METHOD OF USE SMITHKLINE BEECHAM CORP (US) 2001-06-13 EP claimed
EP-1069901-A1 CALCILYTIC COMPOUNDS AND METHOD OF USE SMITHKLINE BEECHAM CORPORATION (US) 2001-01-24 EP claimed
WO-1999051241-A1 CALCILYTIC COMPOUNDS AND METHOD OF USE SMITHKLINE BEECHAM CORPORATION (US) 1999-10-14 WO claimed
CN-105814040-B The condensed 1,4- dihydro two of inhibitor as thermal excited transcryption factor 1 dislikes ene derivative 癌症研究科技有限公司 2019-07-30 CN disclosed
CN-1834795-A Toner, developer, toner container, process cartridge, image forming apparatus and image forming method RICOH KK (JP) 2006-09-20 CN disclosed