SCHEMBL4635829

SCHEMBL4635829

[CH2]C(CCCC)Oc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.44
ALOX5 P09917 2/20 0.39
PPARG P37231 2/20 0.39
PPARA Q07869 1/20 0.39
CNR2 P34972 1/20 0.39
SLC6A4 P31645 2/20 0.39
PTGES O14684 1/20 0.38
MLNR O43193 1/20 0.37
NR1I2 O75469 1/20 0.37
ESR1 P03372 1/20 0.37
NR3C1 P04150 1/20 0.37
PGR P06401 1/20 0.37
ADRB2 P07550 1/20 0.37
CHRM2 P08172 1/20 0.37
ADRB1 P08588 1/20 0.37
HTR1A P08908 1/20 0.37
ADRA2A P08913 1/20 0.37
ADORA3 P0DMS8 1/20 0.37
CHRM1 P11229 1/20 0.37
DRD2 P14416 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
SCHEMBL7976811 0.94 LTA4H (0.44) LTA4HCNR2SLC6A4MLNRNR1I2
SCHEMBL28177008 0.93 LTA4H (0.43) LTA4HCNR2SLC6A4MLNRNR1I2
SCHEMBL8554246 0.93 LTA4H (0.43) LTA4HCNR2SLC6A4MLNRNR1I2
SCHEMBL2518650 0.93 LTA4H (0.43) LTA4HCNR2SLC6A4MLNRNR1I2
SCHEMBL11319699 0.93 LTA4H (0.43) LTA4HCNR2SLC6A4MLNRNR1I2
Ammonia Solution, Strong SCHEMBL17311200 0.91 LTA4H (0.42) LTA4HCNR2SLC6A4MLNRNR1I2
SCHEMBL7350372 0.88 SLC6A4 (0.41) LTA4HPPARGPPARASLC6A4ALDH1A1
SCHEMBL8923714 0.81 PPARA (0.42) PPARGPPARASLC6A4SLC6A2SLC6A3
SCHEMBL11102196 0.81 MTNR1A (0.42) LTA4HSLC6A4MAOAGPR88LMNA
SCHEMBL10768358 0.80 LTA4H (0.37) LTA4HPPARGPPARASLC6A4LMNA

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
CN-114008102-A Water-emulsifiable isocyanates having improved properties 巴斯夫欧洲公司 2022-02-01 CN disclosed
CN-109415452-B Method for producing highly reactive isobutene homo-or copolymers 巴斯夫欧洲公司 2021-10-26 CN disclosed
EP-1931425-A1 ANTITUBERCULOUS COMPOSITION COMPRISING OXAZOLE COMPOUNDS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2008-06-18 EP disclosed
WO-2007043542-A1 ANTITUBERCULOUS COMPOSITION COMPRISING OXAZOLE COMPOUNDS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-04-19 WO disclosed
US-6043227-A C11 carbamates of macrolide antibacterials PFIZER INC. (US) 2000-03-28 US disclosed