SCHEMBL6960554

SCHEMBL6960554

N#Cc1ccccc1OCCCCCCCCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.56
FNTA P49354 3/20 0.53
FNTB P49356 3/20 0.53
PGGT1B P53609 3/20 0.53
ALDH1A1 P00352 3/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
CYSLTR2 Q9NS75 1/20 0.44
CYSLTR1 Q9Y271 1/20 0.44
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
KDM4E B2RXH2 1/20 0.43
FAAH O00519 1/20 0.43
HPGD P15428 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
SCHEMBL6960881 1.00 NAAA (0.56) NAAAFNTAFNTBPGGT1BALDH1A1
SCHEMBL7078940 0.98 FNTA (0.54) NAAAFNTAFNTBPGGT1BALDH1A1
SCHEMBL6957296 0.88 FNTA (0.52) FNTAFNTBPGGT1BALDH1A1MEN1
SCHEMBL9034892 0.88 NAAA (0.52) NAAAFNTAFNTBPGGT1BMAOA
SCHEMBL6538639 0.82 FFAR1 (0.45) NAAAFNTAFNTBPGGT1BCYSLTR2
SCHEMBL3825769 0.81 ALDH1A1 (0.51) ALDH1A1MEN1KMT2AMAOAKDM4E
SCHEMBL80971 0.81 FNTA (0.51) NAAAFNTAFNTBPGGT1BALDH1A1
SCHEMBL3145001 0.80 ALDH1A1 (0.58) ALDH1A1MEN1KMT2AKDM4EHPGD
SCHEMBL16188206 0.80 ALDH1A1 (0.58) ALDH1A1MEN1KMT2AKDM4EHPGD
SCHEMBL2975924 0.80 ALDH1A1 (0.58) ALDH1A1MEN1KMT2AKDM4EHPGD

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-0711762-B1 PROCESS FOR PRODUCING TETRAZOLE COMPOUNDS SUMITOMO CHEMICAL CO (JP) 2003-08-06 EP disclosed
US-6277998-B1 REACTING 2-CYANO-4-OXO-4H-BENZOPYRAN COMPOUND WITH HYDROGEN SULFIDE AND THEN REACTING PROUDCT WITH ALKYL HALIDE; REACTING THE PRODUCT WITH HYDRAZINE OR ITS SALT AND THEN WITH NITROUS ACID COMPOUND TO OBTAIN TETRAZOLE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-08-21 US disclosed
US-6191289-B1 REACTING A 4-OXO-4H-BENZOPYRAN GROUP SUBSTITUTED WITH AMIDE OR A PHENYL GROUP IN ITS 2 POSITION IS REACTED WITH ANHYDROUS HYDRAZINE OR SALT IN PRESENCE OF CATALYST FOLLOWED BY REACTING WITH NITROUS ACID OR SALT TO FORM TETRAZOLE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-02-20 US disclosed
US-5874593-A SULFUR CONTAINING AMIDE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-02-23 US disclosed
EP-0711762-A1 PROCESS FOR PRODUCING TETRAZOLE COMPOUND AND INTERMEDIATE THEREFOR SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1996-05-15 EP disclosed