SCHEMBL5833376

SCHEMBL5833376

Fc1ccc2ccc(Cl)cc2n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 2/20 0.50
HTR3E A5X5Y0 1/20 0.43
HTR3B O95264 1/20 0.43
HTR3A P46098 1/20 0.43
HTR3D Q70Z44 1/20 0.43
HTR3C Q8WXA8 1/20 0.43
DYRK1A Q13627 2/20 0.40
F7 P08709 1/20 0.40
F3 P13726 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40
S1PR4 O95977 1/20 0.40
PIK3CG P48736 1/20 0.39
CYP2A6 P11509 1/20 0.39
CMA1 P23946 1/20 0.39
AHR P35869 1/20 0.39
LMNA P02545 1/20 0.38
CYP1A2 P05177 1/20 0.38
MAPT P10636 1/20 0.38
THRB P10828 1/20 0.38
ALOX15 P16050 1/20 0.38

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
SCHEMBL8396854 0.84 HTR3A (0.45) NR4A2HTR3EHTR3BHTR3AHTR3D
SCHEMBL2133059 0.76 NR4A2 (0.54) NR4A2HTR3EHTR3BHTR3AHTR3D
SCHEMBL6665214 0.76 KDM4E (0.43) CYP2A6AHRLMNACYP1A2MAPT
SCHEMBL30506415 0.76 NR4A2 (0.54) NR4A2HTR3EHTR3BHTR3AHTR3D
SCHEMBL7608692 0.75 NR4A2 (0.52) NR4A2HTR3EHTR3BHTR3AHTR3D
SCHEMBL23779362 0.73 NR4A2 (0.50) NR4A2HTR3EHTR3BHTR3AHTR3D
SCHEMBL462171 0.73 BACE1 (0.58) NR4A2PIK3CGLMNACYP1A2MAPT
SCHEMBL30572491 0.73 ALDH1A1 (0.50) CYP1A2ALOX15PDGFRBPDGFRA
SCHEMBL14720338 0.73 NR4A2 (0.50) NR4A2HTR3EHTR3BHTR3AHTR3D
SCHEMBL27390744 0.73 NR4A2 (0.50) NR4A2HTR3EHTR3BHTR3AHTR3D

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
US-7022855-B2 Halogen-substituted quinoline derivatives and ectoparasite control agent MEIJI SEIKA KAISHA, LTD. (JP) 2006-04-04 US disclosed