SCHEMBL8556933

SCHEMBL8556933

Cc1ccc2ccccc2c1C(=O)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.53
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
ALDH1A1 P00352 4/20 0.50
HTT P42858 1/20 0.50
CYP1A2 P05177 2/20 0.48
TSHR P16473 2/20 0.48
CYP2A6 P11509 1/20 0.48
TAS1R3 Q7RTX0 1/20 0.48
TAS1R1 Q7RTX1 1/20 0.48
TAS1R2 Q8TE23 1/20 0.48
MAPT P10636 2/20 0.47
GAA P10253 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
HPGD P15428 3/20 0.46
KDM4E B2RXH2 2/20 0.46
MEN1 O00255 1/20 0.46
GLA P06280 1/20 0.46
CYP2C19 P33261 1/20 0.46
KMT2A Q03164 1/20 0.46

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
Sulfuric Acid SCHEMBL10833755 0.93 L3MBTL1 (0.48) L3MBTL1NPC1RAB9AALDH1A1HTT
SCHEMBL29626829 0.90 TSHR (0.54) L3MBTL1ALDH1A1CYP1A2TSHRCYP2A6
SCHEMBL230034 0.90 TSHR (0.54) L3MBTL1ALDH1A1CYP1A2TSHRCYP2A6
SCHEMBL12333848 0.85 PTGS2 (0.46) L3MBTL1NPC1RAB9AALDH1A1HTT
SCHEMBL224932 0.85 HPGD (0.59) L3MBTL1ALDH1A1CYP1A2TSHRCYP2A6
SCHEMBL2126233 0.84 HPGD (0.53) NPC1RAB9AALDH1A1CYP1A2TSHR
SCHEMBL6907791 0.83 CYP1A2 (0.57) L3MBTL1ALDH1A1CYP1A2TSHRCYP2A6
Ammonia Solution, Strong SCHEMBL7720483 0.83 CYP1A2 (0.57) L3MBTL1ALDH1A1CYP1A2TSHRCYP2A6
SCHEMBL6916502 0.83 CYP1A2 (0.57) L3MBTL1ALDH1A1CYP1A2TSHRCYP2A6
SCHEMBL6917031 0.83 CYP1A2 (0.57) L3MBTL1ALDH1A1CYP1A2TSHRCYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0475527-B1 Aryl-fused and hetaryl-fused-2,4-diazepine and 2,4-diazocine antiarrhythmic agents SANOFI SA (FR) 1998-02-25 EP disclosed
US-5624922-A Aryl-fused and hetaryl-fused-2,4-diazepine and 2,4-diazocine antiarrhythmic agents STERLING WINTHROP INC. (US) 1997-04-29 US disclosed
EP-0597540-B1 Aryl-fused and hetaryl-fused-2,4-diazocine antiarrhythmic agents STERLING WINTHROP INC (US) 1996-06-05 EP disclosed
US-5380721-A Aryl-fused and hetaryl-fused-2,4-diazepine and 2,4-diazocine antiarrhythmic agents STERLING WINTHROP INC. (US) 1995-01-10 US disclosed
EP-0597540-A1 Aryl-fused and hetaryl-fused-2,4-diazocine antiarrhythmic agents STERLING WINTHROP INC. (US) 1994-05-18 EP disclosed
EP-0475527-A2 Aryl-fused and hetaryl-fused-2, 4-diazepine and 2, 4-diazocine antiarrhythmic agents STERLING DRUG INC. (US) 1992-03-18 EP disclosed
EP-0426846-A1 FLUORINATED-AROMATIC SULFONIC ACID CATALYST, PROCESS FOR ITS PRODUCTION, AND ITS USE MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1991-05-15 EP disclosed
CN-1040332-A Fluorine-containing aromatic sulfonic acid catalyzer and method for making and purposes MITSUI PETROCHEMICAL IND (JP) 1990-03-14 CN disclosed