SCHEMBL7841888

SCHEMBL7841888

CCCC(CCC)Oc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 1/20 0.43
PPARG P37231 3/20 0.42
PPARA Q07869 3/20 0.42
LTA4H P09960 3/20 0.41
KDM4E B2RXH2 1/20 0.39
CA4 P22748 1/20 0.39
MTNR1A P48039 1/20 0.38
MTNR1B P49286 1/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.37
ADRA2A P08913 1/20 0.37
ADRA2B P18089 1/20 0.37
ADRA2C P18825 1/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
NISCH Q9Y2I1 1/20 0.37
MAPT P10636 1/20 0.37

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
SCHEMBL14844285 0.92 LTA4H (0.44) SLC6A4PPARGPPARALTA4HADRA2A
SCHEMBL11065085 0.91 PPARG (0.44) SLC6A4PPARGPPARALTA4HKDM4E
SCHEMBL5050475 0.90 LTA4H (0.44) SLC6A4PPARGPPARALTA4HLMNA
SCHEMBL28280512 0.89 LTA4H (0.43) SLC6A4LTA4HLMNAADRA2AADRA2B
SCHEMBL28013972 0.89 LTA4H (0.43) SLC6A4LTA4HLMNAADRA2AADRA2B
SCHEMBL28997989 0.89 LTA4H (0.43) SLC6A4LTA4HLMNAADRA2AADRA2B
SCHEMBL23974956 0.88 PPARG (0.41) SLC6A4PPARGPPARALTA4HMTNR1A
SCHEMBL8349925 0.88 SLC6A4 (0.39) SLC6A4PPARGPPARALTA4HKDM4E
SCHEMBL1454315 0.87 SLC6A4 (0.36) SLC6A4PPARGPPARALTA4HKDM4E
SCHEMBL22798634 0.87 LTA4H (0.42) SLC6A4LTA4HLMNAADRA2AADRA2B

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-1150565-A1 THIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF LION bioscience AG (DE) 2001-11-07 EP claimed
WO-2000045635-A1 THIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF LION BIOSCIENCE AG (DE) 2000-08-10 WO claimed
CN-107632461-B Varnish for photo-alignment film and liquid crystal display device 株式会社日本显示器 2021-07-27 CN disclosed
CN-108690493-B Varnish for photo-alignment film and liquid crystal display device 株式会社日本显示器 2021-07-27 CN disclosed
US-4304683-A Composition for liquid crystal color display element MITSUI TOATSU CHEMICALS, INC. (JP) 1981-12-08 US disclosed