SCHEMBL3243441

SCHEMBL3243441

FC1=C(c2ccccc2)CCCC1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FGF23 Q9GZV9 1/20 0.46
PTGS2 P35354 3/20 0.41
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
SLC6A3 Q01959 1/20 0.40
CFTR P13569 1/20 0.39
GOPC Q9HD26 1/20 0.39
CHRNB4 P30926 2/20 0.39
CHRNA3 P32297 2/20 0.39
ALDH1A1 P00352 1/20 0.36
MAPK14 Q16539 1/20 0.36
PTGS1 P23219 3/20 0.36
TSHR P16473 1/20 0.36
KMT2A Q03164 1/20 0.34
HPGD P15428 1/20 0.33

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
SCHEMBL8653245 0.82 PTGS2 (0.54) FGF23PTGS2SLC6A2SLC6A4SLC6A3
SCHEMBL30144760 0.79 PTGS2 (0.52) FGF23PTGS2SLC6A2SLC6A4SLC6A3
SCHEMBL30877921 0.79 PTGS2 (0.52) FGF23PTGS2SLC6A2SLC6A4SLC6A3
SCHEMBL8705170 0.79 PTGS2 (0.52) FGF23PTGS2SLC6A2SLC6A4SLC6A3
SCHEMBL8705175 0.79 PTGS2 (0.52) FGF23PTGS2SLC6A2SLC6A4SLC6A3
SCHEMBL8518215 0.76 PTGS2 (0.59) FGF23PTGS2SLC6A2SLC6A4SLC6A3
SCHEMBL27874435 0.75 KMT2A (0.46) FGF23PTGS2SLC6A2SLC6A4SLC6A3
SCHEMBL8389316 0.74 MAPK14 (0.64) FGF23PTGS2SLC6A2SLC6A4SLC6A3
SCHEMBL9806352 0.71 FGF23 (0.41) FGF23PTGS2SLC6A2SLC6A4SLC6A3
SCHEMBL6810189 0.71 FGF23 (0.46) FGF23PTGS2SLC6A2SLC6A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6689291-B1 MIXTURE OF POLAR COMPOUNDS HAVING POSITIVE DIELECTRIC ANISOTROPY, COMPRISING AT LEAST ONE FLUOROPHENYLCYCLOHEXENE DERIVATIVE MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2004-02-10 US claimed
JP-6306361-A None JP disclosed
CN-117881668-A Compound based on isoindoline substituted glutarimide skeleton and application thereof 标新生物医药科技(上海)有限公司 2024-04-12 CN disclosed
EP-1780193-B1 LIQUID CRYSTAL MATERIAL, METHOD FOR PRODUCING LIQUID CRYSTAL MATERIAL AND LIQUID CRYSTAL DEVICE JAPAN SCIENCE & TECH AGENCY (JP) 2010-05-19 EP disclosed
JP-2009138204-A LIQUID CRYSTAL MEDIUM MERCK PATENT GMBH 2009-06-25 JP disclosed
JP-2005113152-A LIQUID-CRYSTAL MEDIUM MERCK PATENT GMBH 2005-04-28 JP disclosed
US-6689291-B1 MIXTURE OF POLAR COMPOUNDS HAVING POSITIVE DIELECTRIC ANISOTROPY, COMPRISING AT LEAST ONE FLUOROPHENYLCYCLOHEXENE DERIVATIVE MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2004-02-10 US disclosed
US-6689291-B1 MIXTURE OF POLAR COMPOUNDS HAVING POSITIVE DIELECTRIC ANISOTROPY, COMPRISING AT LEAST ONE FLUOROPHENYLCYCLOHEXENE DERIVATIVE MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2004-02-10 US disclosed
JP-H06306361-A LIQUID CRYSTAL MEDIUM MERCK PATENT GMBH 1994-11-01 JP disclosed