SCHEMBL28298076

SCHEMBL28298076

Cc1cccc(OCCO)c1OCCO

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.50
KDM4E B2RXH2 1/20 0.50
HTR1A P08908 2/20 0.45
ADRA1D P25100 2/20 0.45
ADRA1A P35348 2/20 0.45
ADRA1B P35368 2/20 0.45
PTPN1 P18031 1/20 0.45
TSHR P16473 2/20 0.44
CHRM2 P08172 2/20 0.44
LMNA P02545 1/20 0.44
CHRM1 P11229 1/20 0.44
ALOX15 P16050 1/20 0.44
ACHE P22303 1/20 0.44
KCNH2 Q12809 1/20 0.44
HIF1A Q16665 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
HTR1B P28222 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
SCN8A Q9UQD0 3/20 0.41
GAA P10253 1/20 0.41

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
SCHEMBL515980 0.88 ALDH1A1 (0.61) ALDH1A1KDM4ETSHRLMNAKCNH2
SCHEMBL8897368 0.86 LMNA (0.52) ALDH1A1KDM4EHTR1AADRA1DADRA1A
SCHEMBL10458228 0.85 HTR1A (0.45) ALDH1A1KDM4EHTR1AADRA1DADRA1A
SCHEMBL516151 0.82 HTR1B (0.62) ALDH1A1KDM4EHTR1ATSHRLMNA
SCHEMBL515977 0.82 ALDH1A1 (0.62) ALDH1A1KDM4ETSHRLMNAL3MBTL1
SCHEMBL6709141 0.81 CYP1A2 (0.52) ALDH1A1KDM4EHTR1AADRA1DADRA1A
SCHEMBL24699931 0.79 CYP1A2 (0.47) ALDH1A1KDM4ETSHRLMNAL3MBTL1
SCHEMBL10633040 0.79 ALDH1A1 (0.44) ALDH1A1KDM4ETSHRHTR1BRECQL
SCHEMBL8301647 0.79 KDM4E (0.61) ALDH1A1KDM4EHTR1ATSHRLMNA
SCHEMBL10629757 0.79 ALDH1A1 (0.49) ALDH1A1KDM4ETSHRLMNAKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109792093-A Deformation detection sensor for sealed secondary battery, and sealed secondary battery 通伊欧轮胎株式会社 2019-05-21 CN disclosed
CN-109690856-A Utilize the manufacturing method and battery pack of the battery pack of used battery 通伊欧轮胎株式会社 2019-04-26 CN disclosed