SCHEMBL8922734

SCHEMBL8922734

N#CCc1ccccc1Oc1ccc(Cl)cc1

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 13/20 0.62
HTR2A P28223 9/20 0.62
SLC6A2 P23975 5/20 0.58
SLC6A3 Q01959 4/20 0.58
MAPT P10636 1/20 0.55
PPARA Q07869 1/20 0.48
KCNH2 Q12809 5/20 0.46
SLC1A5 Q15758 1/20 0.43
HTT P42858 1/20 0.43
HRH1 P35367 1/20 0.41
RIPK1 Q13546 1/20 0.40

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
SCHEMBL4824572 0.86 HRH1 (0.55) SLC6A4HTR2ASLC6A2SLC6A3HRH1
SCHEMBL11240000 0.85 SLC6A4 (0.48) SLC6A4HTR2ASLC6A2SLC6A3KCNH2
SCHEMBL11339338 0.83 SLC6A4 (0.66) SLC6A4HTR2ASLC6A2SLC6A3HRH1
SCHEMBL11578002 0.83 SLC6A4 (0.62) SLC6A4HTR2ASLC6A2SLC6A3MAPT
SCHEMBL10958172 0.83 SLC6A4 (0.58) SLC6A4HTR2ASLC6A2SLC6A3MAPT
SCHEMBL11122829 0.82 SLC6A4 (0.50) SLC6A4HTR2ASLC6A2SLC6A3MAPT
SCHEMBL7770746 0.79 SLC6A4 (0.56) SLC6A4HTR2ASLC6A2SLC6A3KCNH2
SCHEMBL11702925 0.79 SLC6A4 (0.65) SLC6A4HTR2ASLC6A2SLC6A3MAPT
SCHEMBL12929642 0.77 SLC6A4 (0.68) SLC6A4HTR2ASLC6A2SLC6A3MAPT
SCHEMBL4639195 0.77 SLC6A4 (0.63) SLC6A4HTR2ASLC6A2SLC6A3MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5650539-A ALKYLATION, ESTERIFICATION, DEESTERIFICATION, AMIDATION, FUNGICIDES SHIONOGI & CO., LTD. (JP) 1997-07-22 US disclosed
US-5488159-A AMIDATION, METHYLATION, FUNGICIDE SHIONOGI & CO., LTD. (JP) 1996-01-30 US disclosed
US-5380913-A E-Isomers of 2-methoxyimino-N-methyl-2-phenoxyphenylacetamides and alkyl 2-methoxyimino-2-phenoxyphenylacetates produced by reacting Z-isomers with hydrogen chloride or hydrochloric, sulfuric or toluenesulfonic acid in methyl, ethyl or butyl alc SHIONOGI & CO., LTD. (JP) 1995-01-10 US disclosed
EP-0468775-B1 Process for producing methoxyiminoacetamide compounds and intermediates SHIONOGI & CO (JP) 1994-12-14 EP disclosed
EP-0606924-A1 Process for producing E-isomers of methoxyminoacetamide compounds SHIONOGI SEIYAKU KABUSHIKI KAISHA trading under the name of SHIONOGI & CO. LTD. (JP) 1994-07-20 EP disclosed
EP-0605392-A1 Process for producing methoxyminoacetamide compounds SHIONOGI SEIYAKU KABUSHIKI KAISHA trading under the name of SHIONOGI & CO. LTD. (JP) 1994-07-06 EP disclosed
US-5183921-A Agricultural fungicides SHIONOGI & CO., LTD. (JP) 1993-02-02 US disclosed
EP-0468775-A1 Process for producing methoxyiminoacetamide compounds and intermediates SHIONOGI SEIYAKU KABUSHIKI KAISHA trading under the name of SHIONOGI & CO. LTD. (JP) 1992-01-29 EP disclosed
EP-0016261-B1 SPIRO(DIBENZ(B,F)OXEPIN-PIPERIDINES) AND METHODS OF PREPARING SAME HOECHST AKTIENGESELLSCHAFT (DE) 1982-12-29 EP disclosed
EP-0016261-A1 Spiro(dibenz(b,f)oxepin-piperidines) and methods of preparing same HOECHST AKTIENGESELLSCHAFT (DE) 1980-10-01 EP disclosed
US-4198417-A ANALGESICS, ANTIDEPRESSANTS, ANTICONVULSANTS AMERICAN HOECHST CORPORATION (US) 1980-04-15 US disclosed
US-4198418-A ANALGESICS, TRANQUILIZERS, ANTICONVULSANTS AMERICAN HOECHST CORPORATION (US) 1980-04-15 US disclosed