SCHEMBL23322396

SCHEMBL23322396

C=C(CCCc1cccc(C2CCCC2)c1)S(=O)(=O)O

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
KMO O15229 1/20 0.40
DRD2 P14416 6/20 0.38
DRD3 P35462 4/20 0.38
DRD1 P21728 2/20 0.38
DRD4 P21917 2/20 0.38
DRD5 P21918 2/20 0.38
NAAA Q02083 1/20 0.38
EPHX2 P34913 1/20 0.36
ASAH1 Q13510 1/20 0.35
FFAR4 Q5NUL3 1/20 0.34
OPRM1 P35372 3/20 0.34
OPRD1 P41143 3/20 0.34
S1PR1 P21453 1/20 0.33
S1PR3 Q99500 1/20 0.33
S1PR5 Q9H228 1/20 0.33
HTR1A P08908 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
SCHEMBL23322479 0.99 KMO (0.42) HDAC4HDAC2HDAC8KMODRD2
SCHEMBL23322348 0.84 FFAR4 (0.41) FFAR4S1PR1S1PR3S1PR5
SCHEMBL23322371 0.83 FFAR4 (0.41) EPHX2FFAR4S1PR1S1PR3S1PR5
SCHEMBL23322386 0.80 HDAC4 (0.43) HDAC4HDAC2HDAC8KMODRD2
SCHEMBL23322366 0.79 KMO (0.44) HDAC4HDAC2HDAC8KMODRD2
SCHEMBL23322364 0.79 MGLL (0.45) HDAC4HDAC2HDAC8KMODRD2
SCHEMBL23322356 0.78 MGLL (0.44) HDAC4HDAC2HDAC8KMODRD2
SCHEMBL7654251 0.76 DRD2 (0.46) HDAC4HDAC2HDAC8KMODRD2
SCHEMBL23322395 0.76 HDAC4 (0.40) HDAC4HDAC2HDAC8KMODRD2
SCHEMBL23322360 0.76 DRD2 (0.43) HDAC4HDAC2HDAC8KMODRD2

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
US-20210384554-A1 LITHIUM SECONDARY BATTERY ELECTROLYTE FOR REDUCING INTERNAL RESISTANCE OF BATTERY AND LITHIUM SECONDARY BATTERY GUANGZHOU TINCI MATERIALS TECHNOLOGY CO., LTD. (CN) 2021-12-09 US disclosed
EP-3819976-A1 LITHIUM SECONDARY BATTERY ELECTROLYTE FOR REDUCING INTERNAL RESISTANCE OF BATTERY AND LITHIUM SECONDARY BATTERY Guangzhou Tinci Materials Technology Co., Ltd (CN) 2021-05-12 EP disclosed