SCHEMBL23322370

SCHEMBL23322370

O=S(=O)(O)C=CCCCc1ccc(C2CCCCC2)cc1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.39
PTGES2 Q9H7Z7 1/20 0.39
FFAR4 Q5NUL3 8/20 0.38
LMNA P02545 2/20 0.38
HTT P42858 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36
SPHK1 Q9NYA1 2/20 0.36
HAO1 Q9UJM8 1/20 0.36

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
SCHEMBL23322347 0.99 PTGES2 (0.39) RORCPTGES2FFAR4LMNAHTT
SCHEMBL23322475 0.85 KMO (0.41)
SCHEMBL23322409 0.84 PTGES2 (0.39) RORCPTGES2FFAR4LMNAHTT
SCHEMBL23322395 0.83 HDAC4 (0.40)
SCHEMBL23322376 0.77 NAAA (0.37) SMN1; SMN2
SCHEMBL23322380 0.77 PTGES2 (0.44) RORCPTGES2FFAR4LMNAHTT
SCHEMBL23322451 0.76 SPHK1 (0.44) RORCPTGES2FFAR4LMNAHTT
SCHEMBL23322362 0.76 NAAA (0.36)
SCHEMBL23322466 0.76 PTGES2 (0.45) RORCPTGES2FFAR4SPHK1
SCHEMBL23322458 0.75 HDAC3 (0.44) LMNAALDH1A1MAPTSMN1; SMN2

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