SCHEMBL28968211

SCHEMBL28968211

CCCC[Sn]CCCC.c1ccc(O[Sn]Oc2ccccc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 3/20 0.44
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
ADRA2B P18089 1/20 0.37
ADRA2C P18825 1/20 0.37
CHRM3 P20309 1/20 0.37
MAOA P21397 1/20 0.37
CNR1 P21554 1/20 0.37
SLC6A2 P23975 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
Biphenyl SCHEMBL1069092 0.77 ALDH1A1 (0.43) LTA4HALDH1A1SMN1; SMN2GAAMAPT
SCHEMBL28433643 0.76 LTA4H (0.50) LTA4HDRD2MAOADRD3ALDH1A1
Toluene SCHEMBL10855994 0.75 TSHR (0.50) LTA4HHTTLMNASMN1; SMN2TSHR
SCHEMBL29134992 0.75 LTA4H (0.40) LTA4HMLNRNR1I2ESR1NR3C1
SCHEMBL27912403 0.74 LTA4H (0.47) LTA4HMLNRNR1I2ESR1NR3C1
SCHEMBL27444017 0.74 LTA4H (0.47) LTA4HMLNRNR1I2ESR1NR3C1
SCHEMBL28003424 0.74 ALOX15 (0.65) ALDH1A1LMNASMN1; SMN2MAPTKMT2A
Hydrochloric Acid SCHEMBL1074228 0.73 LTA4H (0.47) LTA4HDRD2MAOADRD3ALDH1A1
SCHEMBL2345062 0.73 TSHR (0.58) ALDH1A1CYP3A4MAPK1SMN1; SMN2TSHR
Phosphine SCHEMBL28267037 0.71 LTA4H (0.33) LTA4HSMN1; SMN2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115651604-A Low-odor coated dealcoholized transparent flowing sealant for electronic and electric appliances 上海清臣环保科技有限公司 2023-01-31 CN disclosed